CAS: 75-07-0 Molecular Formula: C₂H₄O Molecular Weight (g/mol): 44.04 MDL Number: MFCD00006991 InChI Key: IKHGUXGNUITLKF-UHFFFAOYSA-N Synonym: ethanal, acetic aldehyde, ethyl aldehyde, acetaldehyd, acetylaldehyde, aldehyde, acetic ethanol, aldeide acetica, octowy aldehyd, aldehyde acetique PubChem CID: 177 ChEBI: CHEBI:15343 IUPAC Name: acetaldehyde SMILES: CC=O

CAS: 4170-30-3 Molecular Formula: C₄H₆O Molecular Weight (g/mol): 70.09 MDL Number: MFCD00007003 InChI Key: MLUCVPSAIODCQM-NSCUHMNNSA-N Synonym: crotonaldehyde, 2-butenal, crotylaldehyde, crotonal, 2e-but-2-enal, trans-crotonaldehyde, e-crotonaldehyde, crotonic aldehyde, 1-formylpropene, trans-2-butenal PubChem CID: 447466 ChEBI: CHEBI:41607 IUPAC Name: (E)-but-2-enal SMILES: CC=CC=O

CAS: 121-33-5 Molecular Formula: C₈H₈O₃ Molecular Weight (g/mol): 152.15 InChI Key: MWOOGOJBHIARFG-UHFFFAOYSA-N Synonym: vanillin, vanillaldehyde, vanillic aldehyde, vanilla, p-vanillin, 2-methoxy-4-formylphenol, vanilline, lioxin, 4-hydroxy-m-anisaldehyde, 3-methoxy-4-hydroxybenzaldehyde PubChem CID: 1183 ChEBI: CHEBI:18346 IUPAC Name: 4-hydroxy-3-methoxybenzaldehyde SMILES: COC1=C(C=CC(=C1)C=O)O

CAS: 72-48-0 Molecular Formula: C14H8O4 Molecular Weight (g/mol): 240.214 MDL Number: MFCD00001201 InChI Key: RGCKGOZRHPZPFP-UHFFFAOYSA-N Synonym: alizarin, alizarin red, mordant red 11, 1,2-dihydroxyanthraquinone, alizarin b, turkey red, 1,2-anthraquinonediol, alizarine, alizarina, alizarine red PubChem CID: 6293 ChEBI: CHEBI:16866 IUPAC Name: 1,2-dihydroxyanthracene-9,10-dione SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)O)O

CAS: 127-17-3 Molecular Formula: C₃H₄O₃ Molecular Weight (g/mol): 88.06 MDL Number: MFCD00002585 InChI Key: LCTONWCANYUPML-UHFFFAOYSA-N Synonym: pyruvic acid, pyroracemic acid, 2-oxopropionic acid, acetylformic acid, alpha-ketopropionic acid, 2-ketopropionic acid, 2-oxopropanoate, propanoic acid, 2-oxo, 2-oxo-propionic acid, 2-oxopropansaeure PubChem CID: 1060 ChEBI: CHEBI:32816 IUPAC Name: 2-oxopropanoic acid SMILES: CC(=O)C(=O)O

CAS: 874-42-0 Molecular Formula: C₇H₄Cl₂O Molecular Weight (g/mol): 175.01 MDL Number: MFCD00003305 InChI Key: YSFBEAASFUWWHU-UHFFFAOYSA-N Synonym: benzaldehyde, 2,4-dichloro, unii-z08ql2124r, ccris 6013, 2,4-dichloro benzaldehyde, 2,4-dichloro-benzaldehyde, acmc-209qnb, dsstox_cid_2130, 2,4 dichloro benzaldehyde, 2,4-di-chlorobenzaldehyde, dsstox_rid_76500 PubChem CID: 13404 IUPAC Name: 2,4-dichlorobenzaldehyde SMILES: C1=CC(=C(C=C1Cl)Cl)C=O

CAS: 619-66-9 Molecular Formula: C₈H₆O₃ Molecular Weight (g/mol): 150.13 MDL Number: MFCD00006951 InChI Key: GOUHYARYYWKXHS-UHFFFAOYSA-N Synonym: 4-carboxybenzaldehyde, benzoic acid, 4-formyl, terephthalaldehydic acid, p-formylbenzoic acid, p-carboxybenzaldehyde, terephthaldehydic acid, 4-carboxybenzaladehyde, 4-formyl-benzoic acid, 4-formylbenzoicacid, unii-ues4qrk36e PubChem CID: 12088 IUPAC Name: 4-formylbenzoic acid SMILES: C1=CC(=CC=C1C=O)C(=O)O

CAS: 206752-32-1 Molecular Formula: C17H14NNaO9S2 Molecular Weight (g/mol): 463.407 MDL Number: MFCD00149588 InChI Key: BEDIAJJRAYEWBI-XXAVUKJNSA-M Synonym: sodium 5-hydroxy-4-2-hydroxybenzylidene amino-7-sulfonaphthalene-2-sulfonate hydrate, sodium 5-hydroxy-4-e-2-hydroxyphenyl methylidene amino-7-sulfonaphthalene-2-sulfonate hydrate, azomethin-h monosodium salt hydrate, 4-hydroxy-5-e-2-hydroxyphenyl methylidene amino-7-sodiooxysulfonyl naphthalene-2-sulfonic acid hydrate, sodium 5-hydroxy-4-2-hydroxyphenyl methylidene amino-7-sulfonaphthalene-2-sulfonate hydrate PubChem CID: 122198137 IUPAC Name: sodium;4-hydroxy-5-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]-7-sulfonaphthalene-2-sulfonate;hydrate SMILES: C1=CC(=CNC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3O)S(=O)(=O)[O-])C(=O)C=C1.O.[Na+]

CAS: 5337-93-9 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.205 MDL Number: MFCD00009312 InChI Key: PATYHUUYADUHQS-UHFFFAOYSA-N Synonym: 4'-methylpropiophenone, 1-p-tolyl propan-1-one, p-methylpropiophenone, 4-methylpropiophenone, 1-4-methylphenyl propan-1-one, 1-propanone, 1-4-methylphenyl, p-tolyl ethyl ketone, p-methyl propiophenone, 1-p-tolylpropan-1-one, 1-4-methylphenyl-1-propanone PubChem CID: 21429 ChEBI: CHEBI:59335 IUPAC Name: 1-(4-methylphenyl)propan-1-one SMILES: CCC(=O)C1=CC=C(C=C1)C

CAS: 879896-48-7 Molecular Formula: C9H8N2OS Molecular Weight (g/mol): 192.236 MDL Number: MFCD08435884 InChI Key: RKARRIJZFBGKSH-UHFFFAOYSA-N Synonym: 1-methyl-3-thien-2-yl-1h-pyrazole-5-carbaldehyde, 1-methyl-3-thiophen-2-yl-1h-pyrazole-5-carbaldehyde, 1-methyl-3-thien-2-yl-1h-pyrazole-5-carboxaldehyde, 1h-pyrazole-5-carboxaldehyde,1-methyl-3-2-thienyl, 2-methyl-5-thiophen-2-yl pyrazole-3-carbaldehyde, 1-methyl-3-2-thienyl-1h-pyrazole-5-carbaldehyde, 1-methyl-3-2-thienyl pyrazole-5-carbaldehyde, 1-methyl-3-2-thienyl-pyrazole-5-carbaldehyde, 2-5-formyl-1-methyl-1h-pyrazol-3-yl thiophene PubChem CID: 18525809 IUPAC Name: 2-methyl-5-thiophen-2-ylpyrazole-3-carbaldehyde SMILES: CN1C(=CC(=N1)C2=CC=CS2)C=O

CAS: 129604-27-9 Molecular Formula: C9H6ClF3O2 Molecular Weight (g/mol): 238.59 MDL Number: MFCD12545820 InChI Key: BUSQQCHYIYPNTO-UHFFFAOYSA-N Synonym: 1-3-chloro-4-trifluoromethoxy phenyl ethanone, 3-chloro-4-trifluoromethoxy acetophenone, 3'-chloro-4'-trifluoromethoxyacetophenone, 3'-chloro-4'-trifluoromethoxy acetophenone, intermediates-zcf02001, ethanone, 1-3-chloro-4-trifluoromethoxy phenyl, 1-3-chloro-4-trifluoromethoxy phenyl ethan-1-one PubChem CID: 14793273 IUPAC Name: 1-[3-chloro-4-(trifluoromethoxy)phenyl]ethanone SMILES: CC(=O)C1=CC(=C(C=C1)OC(F)(F)F)Cl

CAS: 105515-20-6 Molecular Formula: C8H6BrFO Molecular Weight (g/mol): 217.037 MDL Number: MFCD11847746 InChI Key: MZDXPUDHZBCYGS-UHFFFAOYSA-N Synonym: 1-3-bromo-5-fluorophenyl ethanone, 3'-bromo-5'-fluoroacetophenone, 1-3-bromo-5-fluorophenyl ethan-1-one, ethanone, 1-3-bromo-5-fluorophenyl, 3-bromo-5-fluoroacetophenone, pubchem22227, 1-3-bromo-5-fluoro-phenyl-ethanone PubChem CID: 13730359 IUPAC Name: 1-(3-bromo-5-fluorophenyl)ethanone SMILES: CC(=O)C1=CC(=CC(=C1)Br)F

CAS: 15492-52-1 Molecular Formula: C33H57O6Yb Molecular Weight (g/mol): 722.867 MDL Number: MFCD00000034 InChI Key: KACMHCBXMZUMQV-LWTKGLMZSA-K Synonym: 2,2,6,6-tetramethylheptane-3,5-dione; ytterbium 3+, ytterbium 3+ tris 3z-2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate, tris 2,2,6,6-tetramethyl-3,5-heptanedionato ytterbium iii-yb reo yb tmhd 3 PubChem CID: 44473428 IUPAC Name: (Z)-2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate;ytterbium(3+) SMILES: CC(C)(C)C(=CC(=O)C(C)(C)C)[O-].CC(C)(C)C(=CC(=O)C(C)(C)C)[O-].CC(C)(C)C(=CC(=O)C(C)(C)C)[O-].[Yb+3]

CAS: 308103-40-4 Molecular Formula: C₈H₉BO₃ Molecular Weight (g/mol): 163.97 MDL Number: MFCD01321263 InChI Key: ZKAOVABYLXQUTI-UHFFFAOYSA-N Synonym: 2-acetylphenyl boronic acid, boronic acid, 2-acetylphenyl, 2'-boronoacetophenone, 1-2-boronophenyl ethan-1-one, 2-acetylbenzeneboronic acid, 2-acetylbenzenboronicacid, 1-2-dihydroxyboranyl phenyl ethan-1-one, 2-acetylphenylboronicacid, pubchem5373, acmc-1agh6 PubChem CID: 2734309 IUPAC Name: (2-acetylphenyl)boronic acid SMILES: B(C1=CC=CC=C1C(=O)C)(O)O

CAS: 608-05-9 Molecular Formula: C9H7NO2 Molecular Weight (g/mol): 161.16 MDL Number: MFCD00005721 InChI Key: VAJCSPZKMVQIAP-UHFFFAOYSA-N Synonym: 5-methylisatin, 5-methylindoline-2,3-dione, 5-methylindole-2,3-dione, 1h-indole-2,3-dione, 5-methyl, indole-2,3-dione, 5-methyl, 5-methyl-2,3-dihydro-1h-indole-2,3-dione, 5-methyl-2,3-indolinedione, 5-methyl-indole-2,3-dione, 5-methylindole-2,3 1h-dione, 5-methyl-1h-benzo d azolidine-2,3-dione PubChem CID: 11840 IUPAC Name: 5-methyl-1H-indole-2,3-dione SMILES: CC1=CC2=C(C=C1)NC(=O)C2=O

CAS: 15118-67-9 Molecular Formula: C13H16O4 Molecular Weight (g/mol): 236.267 MDL Number: MFCD00051784 InChI Key: FYUAOZFEVHSJTO-UHFFFAOYSA-N Synonym: ethyl 3-4-methoxybenzoyl propionate, ethyl 4-4-methoxyphenyl-4-oxobutanoate, ethyl 4-4-methoxyphenyl-4-oxobutyrate, acmc-1ciqg, ethyl 3-4-methoxybenzoylpropionate, ethyl 3-4-methoxybenzoyl propanoate, ethyl 3-4-methoxybenzoyl-propionate, ethyl 4-4-methoxyphenyl-4-oxobutanoate #, gamma-oxo-4-methoxybenzenebutyric acid ethyl ester, 4-4-methoxyphenyl-4-oxobutyric acid, ethyl ester PubChem CID: 585132 IUPAC Name: ethyl 4-(4-methoxyphenyl)-4-oxobutanoate SMILES: CCOC(=O)CCC(=O)C1=CC=C(C=C1)OC

CAS: 64328-68-3 Molecular Formula: C13H17BrO Molecular Weight (g/mol): 269.182 MDL Number: MFCD00218837 InChI Key: AVYNDJWQMUOSJZ-UHFFFAOYSA-N Synonym: 2-bromo-1-4-pentylphenyl ethan-1-one, 2-bromo-1-4-pentylphenyl ethanone, 2-bromo-4'-pent-1-yl acetophenone, ethanone,2-bromo-1-4-pentylphenyl, 2-bromo-1-4-pent-1-yl phenyl ethan-1-one PubChem CID: 2775670 IUPAC Name: 2-bromo-1-(4-pentylphenyl)ethanone SMILES: CCCCCC1=CC=C(C=C1)C(=O)CBr

CAS: 98-01-1 Molecular Formula: C₅H₄O₂ Molecular Weight (g/mol): 96.08 MDL Number: MFCD00003229 InChI Key: HYBBIBNJHNGZAN-UHFFFAOYSA-N Synonym: furfural, 2-furaldehyde, 2-furancarboxaldehyde, furaldehyde, 2-formylfuran, furfuraldehyde, fural, 2-furanaldehyde, 2-furancarbonal, 2-furfural PubChem CID: 7362 ChEBI: CHEBI:34768 IUPAC Name: furan-2-carbaldehyde SMILES: C1=COC(=C1)C=O

CAS: 916792-16-0 Molecular Formula: C12H15NO2 Molecular Weight (g/mol): 205.257 MDL Number: MFCD08060944 InChI Key: KTDSNAKFASLMHF-UHFFFAOYSA-N Synonym: 2-cyclohexyloxypyridine-5-carboxaldehyde, 6-cyclohexyloxy nicotinaldehyde, 6-cyclohexyloxy pyridine-3-carbaldehyde, 6-cyclohexyl-oxy pyridine-3-carbaldehyde PubChem CID: 42553152 IUPAC Name: 6-cyclohexyloxypyridine-3-carbaldehyde SMILES: C1CCC(CC1)OC2=NC=C(C=C2)C=O

CAS: 851263-13-3 Molecular Formula: C11H11F3O2 Molecular Weight (g/mol): 232.202 MDL Number: MFCD13196590 InChI Key: KWNZFVILRICPQN-UHFFFAOYSA-N Synonym: 4'-ethoxy-3'-trifluoromethyl acetophenone, 1-4-ethoxy-3-trifluoromethyl phenyl ethanone, 1-acetyl-4-ethoxy-3-trifluoromethyl benzene PubChem CID: 57361403 IUPAC Name: 1-[4-ethoxy-3-(trifluoromethyl)phenyl]ethanone SMILES: CCOC1=C(C=C(C=C1)C(=O)C)C(F)(F)F

CAS: 712-50-5 Molecular Formula: C13H16O Molecular Weight (g/mol): 188.27 MDL Number: MFCD00001467 InChI Key: BMFYCFSWWDXEPB-UHFFFAOYSA-N Synonym: cyclohexyl phenyl ketone, cyclohexyl phenyl methanone, benzoylcyclohexane, cyclohexylphenylketone, benzoyl cyclohexane, phenyl cyclohexyl ketone, methanone, cyclohexylphenyl, cyclohexyl-phenyl-methanone, usaf kf-3, cyclohexylphenyl ketone PubChem CID: 12837 IUPAC Name: cyclohexyl(phenyl)methanone SMILES: C1CCC(CC1)C(=O)C2=CC=CC=C2

CAS: 121872-94-4 Molecular Formula: C8H5ClF2O Molecular Weight (g/mol): 190.574 MDL Number: MFCD00671761 InChI Key: BNODNMUCMFITCS-UHFFFAOYSA-N Synonym: 2'-chloro-4',5'-difluoroacetophenone, 1-2-chloro-4,5-difluorophenyl ethanone, 2-chloro-4,5-difluoroacetophenone, 1-2-chloro-4,5-difluoro-phenyl ethanone, ethanone,1-2-chloro-4,5-difluorophenyl, ethanone, 1-2-chloro-4,5-difluorophenyl, 2-chloro-4 ,5-difluoroacetophenone, 1-acetyl-2-chloro-4,5-difluorobenzene, acmc-20dywg, pubchem4109 PubChem CID: 2736489 IUPAC Name: 1-(2-chloro-4,5-difluorophenyl)ethanone SMILES: CC(=O)C1=CC(=C(C=C1Cl)F)F

CAS: 104-53-0 Molecular Formula: C₉H₁₀O Molecular Weight (g/mol): 134.18 MDL Number: MFCD00007021 InChI Key: YGCZTXZTJXYWCO-UHFFFAOYSA-N Synonym: benzenepropanal, 3-phenylpropionaldehyde, hydrocinnamaldehyde, hydrocinnamic aldehyde, dihydrocinnamaldehyde, benzylacetaldehyde, 3-phenyl-1-propanal, 3-phenylpropylaldehyde, 3-phenylpropyl aldehyde, propanal, phenyl PubChem CID: 7707 IUPAC Name: 3-phenylpropanal SMILES: C1=CC=C(C=C1)CCC=O

CAS: 38220-75-6 Molecular Formula: C10H7BrO2 Molecular Weight (g/mol): 239.068 MDL Number: MFCD00276737 InChI Key: YPIQPBGNNXXKNI-UHFFFAOYSA-N Synonym: 1-5-bromo-1-benzofuran-2-yl ethanone, 2-acetyl-5-bromobenzo b furan, 1-5-bromobenzofuran-2-yl ethanone, 1-5-bromo-1-benzofuran-2-yl ethan-1-one, 2-acetyl-5-bromobenzofuran, ethanone, 1-5-bromo-2-benzofuranyl, acmc-1ajfl, maybridge1_001462, 2-acetyl-5-bromo benzo b furan, ypiqpbgnnxxkni-uhfffaoysa PubChem CID: 705670 IUPAC Name: 1-(5-bromo-1-benzofuran-2-yl)ethanone SMILES: CC(=O)C1=CC2=C(O1)C=CC(=C2)Br

CAS: 78-98-8 Molecular Formula: C3H4O2 Molecular Weight (g/mol): 72.063 MDL Number: MFCD00006960 InChI Key: AIJULSRZWUXGPQ-UHFFFAOYSA-N Synonym: methylglyoxal, pyruvaldehyde, pyruvic aldehyde, acetylformaldehyde, acetylformyl, propanal, 2-oxo, 2-ketopropionaldehyde, propanedione, propanolone, methyl glyoxal PubChem CID: 880 ChEBI: CHEBI:17158 IUPAC Name: 2-oxopropanal SMILES: CC(=O)C=O

CAS: 2491-37-4 Molecular Formula: C₈H₇BrO₂ Molecular Weight (g/mol): 215.04 MDL Number: MFCD05664326 InChI Key: IEPSGFQQGKPTPM-UHFFFAOYSA-N Synonym: 2-bromo-1-3-hydroxyphenyl ethanone, 2-bromo-3'-hydroxyacetophenone, 2-bromo-3-hydroxyacetophenone, ethanone, 2-bromo-1-3-hydroxyphenyl, 3-hydroxyphenacyl bromide, 2-bromo-1-3-hydroxyphenyl ethan-1-one, ethanone,2-bromo-1-3-hydroxyphenyl, 2-bromo-3`-hydroxyacetophenone, 2-bromo-3'-hydroxy-acetophenone, tos-bb-1139 PubChem CID: 6917206 IUPAC Name: 2-bromo-1-(3-hydroxyphenyl)ethanone SMILES: C1=CC(=CC(=C1)O)C(=O)CBr

CAS: 51756-08-2 Molecular Formula: C7H12O3 Molecular Weight (g/mol): 144.17 MDL Number: MFCD01632136 InChI Key: YXLVLOWNJCOOAU-UHFFFAOYSA-N Synonym: methyl 2-ethylacetoacetate, butanoic acid, 2-ethyl-3-oxo-, methyl ester, methyl-2-ethylacetoacetate, 2-ethyl-3-oxobutanoic acid, methyl ester, methyl ethylacetoacetate, methyl acetylbutyrate, methyl 2-acetylbutyrate, acmc-1b06q, methyl 2-ethyl-3-oxobutyrate, methyl 2-ethyl-3-oxo-butyrate PubChem CID: 103534 IUPAC Name: methyl 2-ethyl-3-oxobutanoate SMILES: CCC(C(=O)C)C(=O)OC

CAS: 13750-81-7 Molecular Formula: C5H6N2O Molecular Weight (g/mol): 110.116 MDL Number: MFCD01321308 InChI Key: UEBFLTZXUXZPJO-UHFFFAOYSA-N Synonym: 1-methyl-1h-imidazole-2-carbaldehyde, 1-methyl-2-imidazolecarboxaldehyde, 1-methylimidazole-2-carboxaldehyde, 1h-imidazole-2-carboxaldehyde, 1-methyl, 2-formyl-1-methylimidazole, imidazole-2-carboxaldehyde, 1-methyl, pubchem7614, zlchem 1231, 2-formyl-l-methylimidazole, acmc-209ce6 PubChem CID: 139575 IUPAC Name: 1-methylimidazole-2-carbaldehyde SMILES: CN1C=CN=C1C=O