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Carbonyl compounds

Organic compounds that contain one or more carbonyl (a carbon atom with a double bond to an oxygen atom) functional groups. Includes compounds with functional groups that contain a carbonyl in their structure such as ketones, aldehydes, and others.
Complex Aldehydes (5,976)
Complex Ketones (4,366)
Dicarbonyl Compounds (579)
Alpha beta-unsaturated carbonyl compounds (544)
Acyloins (104)

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76
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Chromium(III) acetylacetonate, 97%

CAS: 21679-31-2 Molecular Formula: C15H21CrO6 Molecular Weight (g/mol): 349.32 MDL Number: MFCD00000015 MFCD00000015 InChI Key: JWORPXLMBPOPPU-LNTINUHCSA-K Synonym: chromium iii acetylacetonate,dsstox_cid_30421,dsstox_gsid_51863 PubChem CID: 91759531 IUPAC Name: chromium;(Z)-4-oxoniumylidenepent-2-en-2-olate SMILES: [Cr+3].C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O

PubChem CID 91759531
CAS 21679-31-2
Molecular Weight (g/mol) 349.32
MDL Number MFCD00000015 MFCD00000015
SMILES [Cr+3].C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O
Synonym chromium iii acetylacetonate,dsstox_cid_30421,dsstox_gsid_51863
IUPAC Name chromium;(Z)-4-oxoniumylidenepent-2-en-2-olate
InChI Key JWORPXLMBPOPPU-LNTINUHCSA-K
Molecular Formula C15H21CrO6
77
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Dimethyl malonate, 98+%

CAS: 108-59-8 Molecular Formula: C5H8O4 Molecular Weight (g/mol): 132.115 MDL Number: MFCD00008460 InChI Key: BEPAFCGSDWSTEL-UHFFFAOYSA-N Synonym: dimethyl malonate,methyl malonate,propanedioic acid, dimethyl ester,malonic acid dimethyl ester,1,3-dimethyl propanedioate,dimethyl 1,3-propanedioate,malonic acid, dimethyl ester,unii-em8y79998c,ccris 8981,propanedioic acid dimethyl ester PubChem CID: 7943 IUPAC Name: dimethyl propanedioate SMILES: COC(=O)CC(=O)OC

PubChem CID 7943
CAS 108-59-8
Molecular Weight (g/mol) 132.115
MDL Number MFCD00008460
SMILES COC(=O)CC(=O)OC
Synonym dimethyl malonate,methyl malonate,propanedioic acid, dimethyl ester,malonic acid dimethyl ester,1,3-dimethyl propanedioate,dimethyl 1,3-propanedioate,malonic acid, dimethyl ester,unii-em8y79998c,ccris 8981,propanedioic acid dimethyl ester
IUPAC Name dimethyl propanedioate
InChI Key BEPAFCGSDWSTEL-UHFFFAOYSA-N
Molecular Formula C5H8O4
78
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1,3-Dichloroacetone, 96%

CAS: 534-07-6 Molecular Formula: C3H4Cl2O Molecular Weight (g/mol): 126.96 MDL Number: MFCD00000937 InChI Key: SUNMBRGCANLOEG-UHFFFAOYSA-N Synonym: 1,3-dichloroacetone,1,3-dichloro-2-propanone,1,3-dichloropropanone,s-dichloroacetone,sym-dichloroacetone,bis chloromethyl ketone,2-propanone, 1,3-dichloro,acetone, 1,3-dichloro,chloromethyl ketone PubChem CID: 10793 IUPAC Name: 1,3-dichloropropan-2-one SMILES: ClCC(=O)CCl

PubChem CID 10793
CAS 534-07-6
Molecular Weight (g/mol) 126.96
MDL Number MFCD00000937
SMILES ClCC(=O)CCl
Synonym 1,3-dichloroacetone,1,3-dichloro-2-propanone,1,3-dichloropropanone,s-dichloroacetone,sym-dichloroacetone,bis chloromethyl ketone,2-propanone, 1,3-dichloro,acetone, 1,3-dichloro,chloromethyl ketone
IUPAC Name 1,3-dichloropropan-2-one
InChI Key SUNMBRGCANLOEG-UHFFFAOYSA-N
Molecular Formula C3H4Cl2O
79
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4-Hexyloxybenzaldehyde, 99%, Thermo Scientific™

CAS: 5736-94-7 Molecular Formula: C13H18O2 Molecular Weight (g/mol): 206.28 MDL Number: MFCD00016615 InChI Key: GWXUVWKBVROFDM-UHFFFAOYSA-N Synonym: 4-hexyloxy benzaldehyde,4-hexyloxybenzaldehyde,4-n-hexyloxybenzaldehyde,p-hexyloxybenzaldehyde,benzaldehyde, 4-hexyloxy,benzaldehyde, p-hexyloxy,p-hexyloxy benzaldehyde,p-hexoxybenzaldehyde,4-hexyloxbenzaldehyde,p-n-hexyloxybenzaldehyde PubChem CID: 79816 IUPAC Name: 4-hexoxybenzaldehyde SMILES: CCCCCCOC1=CC=C(C=C1)C=O

PubChem CID 79816
CAS 5736-94-7
Molecular Weight (g/mol) 206.28
MDL Number MFCD00016615
SMILES CCCCCCOC1=CC=C(C=C1)C=O
Synonym 4-hexyloxy benzaldehyde,4-hexyloxybenzaldehyde,4-n-hexyloxybenzaldehyde,p-hexyloxybenzaldehyde,benzaldehyde, 4-hexyloxy,benzaldehyde, p-hexyloxy,p-hexyloxy benzaldehyde,p-hexoxybenzaldehyde,4-hexyloxbenzaldehyde,p-n-hexyloxybenzaldehyde
IUPAC Name 4-hexoxybenzaldehyde
InChI Key GWXUVWKBVROFDM-UHFFFAOYSA-N
Molecular Formula C13H18O2
80
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Glutaric dialdehyde, electron microscopy grade, 25% solution in water, purified

CAS: 111-30-8 | C5H8O2 | 100.12 g/mol

Linear Formula OHC(CH2)3CHO
Molecular Weight (g/mol) 100.12
ChEBI CHEBI:64276
InChI Key SXRSQZLOMIGNAQ-UHFFFAOYSA-N
Density 1.0600g/mL
PubChem CID 3485
Name Note Purified
Percent Purity 25 to 27 wt%
Fieser 01,411
pH 3.1 to 4.5 (25°C)
Formula Weight 100.12
Melting Point -5.0°C
Boiling Point 101°C
Physical Form Solution
Chemical Name or Material Glutaric dialdehyde, electron microscopy grade
Grade E.M.
SMILES O=CCCCC=O
Merck Index 15, 4508
CAS 7732-18-5
Health Hazard 3 GHS P Statement
IF SWALLOWED: rinse mouth.
Do NOT induce vomiting.
IF IN EYES: Rinse cautiously with water for several minutes.
Remove contact lenses,if present and easy to do.
Continue rinsing.
Immediately call a POISON CENTER
MDL Number MFCD00007025
Health Hazard 2 GHS H Statement
May cause an allergic skin reaction.
May cause allergy or asthma symptoms or breathing difficulties if inhaled.
Causes severe skin burns and eye damage.
Harmful if swallowed.
Harmful if inhaled.
Very t
Solubility Information Solubility in water: soluble
Packaging Glass bottle
Health Hazard 1 GHS Signal Word: Danger
Refractive Index 1.373
Synonym glutaraldehyde,glutaral,glutaric dialdehyde,cidex,glutardialdehyde,1,5-pentanedial,sonacide,glutarol,aldesan,glutaric aldehyde
IUPAC Name pentanedial
Beilstein 01, 776
Molecular Formula C5H8O2
EINECS Number 203-856-5
Specific Gravity 1.06
81
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D-Psicose, 98%

CAS: 551-68-8 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.16 MDL Number: MFCD00083478 InChI Key: BJHIKXHVCXFQLS-PUFIMZNGSA-N Synonym: erythrohexulose,3r,4r,5r-1,3,4,5,6-pentahydroxyhexan-2-one,pseudofructose,unii-qcc18lng3e,d-ribo-hex-2-ulose,qcc18lng3e,dl-psicose,ribo-2-hexulose,d-ribo-2-ketohexose,keto-d-psicose PubChem CID: 90008 ChEBI: CHEBI:27605 IUPAC Name: (3R,4R,5R)-1,3,4,5,6-pentahydroxyhexan-2-one SMILES: C(C(C(C(C(=O)CO)O)O)O)O

PubChem CID 90008
CAS 551-68-8
Molecular Weight (g/mol) 180.16
ChEBI CHEBI:27605
MDL Number MFCD00083478
SMILES C(C(C(C(C(=O)CO)O)O)O)O
Synonym erythrohexulose,3r,4r,5r-1,3,4,5,6-pentahydroxyhexan-2-one,pseudofructose,unii-qcc18lng3e,d-ribo-hex-2-ulose,qcc18lng3e,dl-psicose,ribo-2-hexulose,d-ribo-2-ketohexose,keto-d-psicose
IUPAC Name (3R,4R,5R)-1,3,4,5,6-pentahydroxyhexan-2-one
InChI Key BJHIKXHVCXFQLS-PUFIMZNGSA-N
Molecular Formula C6H12O6
82
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Thermo Scientific Chemicals 2-Deoxy-D-ribose, 99%

CAS: 533-67-5 Molecular Formula: C5H10O4 Molecular Weight (g/mol): 134.13 MDL Number: MFCD00135904 InChI Key: PDWIQYODPROSQH-GLULIZFNNA-N Synonym: 2-deoxy-d-ribose,thyminose,3s,4r-3,4,5-trihydroxypentanal,deoxyribose,2-deoxy-d-erythro-pentose,2-deoxyribose,d-drib,2-deoxy-d-arabinose,unii-lsw4h01241,2-deoxy-d-erythropentose PubChem CID: 5460005 ChEBI: CHEBI:28816 IUPAC Name: (3S,4R)-3,4,5-trihydroxypentanal SMILES: OC[C@H]1OC(O)C[C@@H]1O

PubChem CID 5460005
CAS 533-67-5
Molecular Weight (g/mol) 134.13
ChEBI CHEBI:28816
MDL Number MFCD00135904
SMILES OC[C@H]1OC(O)C[C@@H]1O
Synonym 2-deoxy-d-ribose,thyminose,3s,4r-3,4,5-trihydroxypentanal,deoxyribose,2-deoxy-d-erythro-pentose,2-deoxyribose,d-drib,2-deoxy-d-arabinose,unii-lsw4h01241,2-deoxy-d-erythropentose
IUPAC Name (3S,4R)-3,4,5-trihydroxypentanal
InChI Key PDWIQYODPROSQH-GLULIZFNNA-N
Molecular Formula C5H10O4
83
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2-Chlorocyclopentanone, 97%, stabilized

CAS: 694-28-0 Molecular Formula: C5H7ClO Molecular Weight (g/mol): 118.56 MDL Number: MFCD00001410 InChI Key: AXDZFGRFZOQVBV-UHFFFAOYNA-N Synonym: 2-chlorocyclopentanone,cyclopentanone, 2-chloro,2-chloro-1-cyclopentanone,alpha-chlorocyclopentanone,2-chlorocyclopentan-one,.alpha.-chlorocyclopentanone,chlorocyclopentanone,o-chlorocyclopentanone,wln: l5vtj bg,acmc-209u9b PubChem CID: 12751 IUPAC Name: 2-chlorocyclopentan-1-one SMILES: ClC1CCCC1=O

PubChem CID 12751
CAS 694-28-0
Molecular Weight (g/mol) 118.56
MDL Number MFCD00001410
SMILES ClC1CCCC1=O
Synonym 2-chlorocyclopentanone,cyclopentanone, 2-chloro,2-chloro-1-cyclopentanone,alpha-chlorocyclopentanone,2-chlorocyclopentan-one,.alpha.-chlorocyclopentanone,chlorocyclopentanone,o-chlorocyclopentanone,wln: l5vtj bg,acmc-209u9b
IUPAC Name 2-chlorocyclopentan-1-one
InChI Key AXDZFGRFZOQVBV-UHFFFAOYNA-N
Molecular Formula C5H7ClO
84
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4'-Aminoacetophenone, 99%

CAS: 99-92-3 Molecular Formula: C8H9NO Molecular Weight (g/mol): 135.17 MDL Number: MFCD00007896 InChI Key: GPRYKVSEZCQIHD-UHFFFAOYSA-N Synonym: 4'-aminoacetophenone,4-aminoacetophenone,1-4-aminophenyl ethanone,p-aminoacetophenone,4-acetylaniline,p-acetylaniline,ethanone, 1-4-aminophenyl,p-aminoacetylbenzene,1-4-aminophenyl ethan-1-one,acetophenone, p-amino PubChem CID: 7468 IUPAC Name: 1-(4-aminophenyl)ethanone SMILES: CC(=O)C1=CC=C(N)C=C1

PubChem CID 7468
CAS 99-92-3
Molecular Weight (g/mol) 135.17
MDL Number MFCD00007896
SMILES CC(=O)C1=CC=C(N)C=C1
Synonym 4'-aminoacetophenone,4-aminoacetophenone,1-4-aminophenyl ethanone,p-aminoacetophenone,4-acetylaniline,p-acetylaniline,ethanone, 1-4-aminophenyl,p-aminoacetylbenzene,1-4-aminophenyl ethan-1-one,acetophenone, p-amino
IUPAC Name 1-(4-aminophenyl)ethanone
InChI Key GPRYKVSEZCQIHD-UHFFFAOYSA-N
Molecular Formula C8H9NO
85
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Acetoacetamide, 97%

CAS: 5977-14-0 InChI Key: GCPWJFKTWGFEHH-UHFFFAOYSA-N Synonym: acetoacetamide,acetylacetamide,acetoacetic acid amide,butanamide, 3-oxo,3-oxobutanamid,unii-6o9u7cfy0t,6o9u7cfy0t,3-oxobutyramide,acmc-20alv9 PubChem CID: 80077 ChEBI: CHEBI:28515 IUPAC Name: 3-oxobutanamide SMILES: CC(=O)CC(=O)N

PubChem CID 80077
CAS 5977-14-0
ChEBI CHEBI:28515
SMILES CC(=O)CC(=O)N
Synonym acetoacetamide,acetylacetamide,acetoacetic acid amide,butanamide, 3-oxo,3-oxobutanamid,unii-6o9u7cfy0t,6o9u7cfy0t,3-oxobutyramide,acmc-20alv9
IUPAC Name 3-oxobutanamide
InChI Key GCPWJFKTWGFEHH-UHFFFAOYSA-N
86
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Benzil, 99+%

CAS: 134-81-6 Molecular Formula: C14H10O2 Molecular Weight (g/mol): 210.23 MDL Number: MFCD00003080 InChI Key: WURBFLDFSFBTLW-UHFFFAOYSA-N Synonym: benzil,diphenylethanedione,dibenzoyl,diphenylglyoxal,bibenzoyl,ethanedione, diphenyl,1,2-diphenylethanedione,diphenylethane-1,2-dione,glyoxal, diphenyl,diphenyldiketon PubChem CID: 8651 ChEBI: CHEBI:51507 IUPAC Name: 1,2-diphenylethane-1,2-dione SMILES: O=C(C(=O)C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 8651
CAS 134-81-6
Molecular Weight (g/mol) 210.23
ChEBI CHEBI:51507
MDL Number MFCD00003080
SMILES O=C(C(=O)C1=CC=CC=C1)C1=CC=CC=C1
Synonym benzil,diphenylethanedione,dibenzoyl,diphenylglyoxal,bibenzoyl,ethanedione, diphenyl,1,2-diphenylethanedione,diphenylethane-1,2-dione,glyoxal, diphenyl,diphenyldiketon
IUPAC Name 1,2-diphenylethane-1,2-dione
InChI Key WURBFLDFSFBTLW-UHFFFAOYSA-N
Molecular Formula C14H10O2
87
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Dodecanal, 95%, stab.

CAS: 112-54-9 Molecular Formula: C12H24O Molecular Weight (g/mol): 184.32 MDL Number: MFCD00007017 InChI Key: HFJRKMMYBMWEAD-UHFFFAOYSA-N Synonym: lauraldehyde,dodecyl aldehyde,lauric aldehyde,lauryl aldehyde,n-dodecanal,dodecanaldehyde,1-dodecanal,n-dodecyl aldehyde,n-lauraldehyde,n-dodecylic aldehyde PubChem CID: 8194 ChEBI: CHEBI:27836 IUPAC Name: dodecanal SMILES: CCCCCCCCCCCC=O

PubChem CID 8194
CAS 112-54-9
Molecular Weight (g/mol) 184.32
ChEBI CHEBI:27836
MDL Number MFCD00007017
SMILES CCCCCCCCCCCC=O
Synonym lauraldehyde,dodecyl aldehyde,lauric aldehyde,lauryl aldehyde,n-dodecanal,dodecanaldehyde,1-dodecanal,n-dodecyl aldehyde,n-lauraldehyde,n-dodecylic aldehyde
IUPAC Name dodecanal
InChI Key HFJRKMMYBMWEAD-UHFFFAOYSA-N
Molecular Formula C12H24O
88
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2-Ketoglutaric acid, 98%

CAS: 328-50-7 Molecular Formula: C5H6O5 Molecular Weight (g/mol): 146.098 MDL Number: MFCD00004165 InChI Key: KPGXRSRHYNQIFN-UHFFFAOYSA-N Synonym: 2-ketoglutaric acid,alpha-ketoglutaric acid,2-oxoglutaric acid,2-oxoglutarate,oxoglutaric acid,alpha-ketoglutarate,2-ketoglutarate,alphaketoglutaric acid,alpha-oxoglutaric acid,2-oxo-1,5-pentanedioic acid PubChem CID: 51 ChEBI: CHEBI:30915 IUPAC Name: 2-oxopentanedioic acid SMILES: C(CC(=O)O)C(=O)C(=O)O

PubChem CID 51
CAS 328-50-7
Molecular Weight (g/mol) 146.098
ChEBI CHEBI:30915
MDL Number MFCD00004165
SMILES C(CC(=O)O)C(=O)C(=O)O
Synonym 2-ketoglutaric acid,alpha-ketoglutaric acid,2-oxoglutaric acid,2-oxoglutarate,oxoglutaric acid,alpha-ketoglutarate,2-ketoglutarate,alphaketoglutaric acid,alpha-oxoglutaric acid,2-oxo-1,5-pentanedioic acid
IUPAC Name 2-oxopentanedioic acid
InChI Key KPGXRSRHYNQIFN-UHFFFAOYSA-N
Molecular Formula C5H6O5
89
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3'-Hydroxyacetophenone, 99+%

CAS: 121-71-1 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 MDL Number: MFCD00002298 InChI Key: LUJMEECXHPYQOF-UHFFFAOYSA-N Synonym: 3'-hydroxyacetophenone,3-hydroxyacetophenone,1-3-hydroxyphenyl ethanone,m-hydroxyacetophenone,3-acetylphenol,1-3-hydroxyphenyl ethan-1-one,ethanone, 1-3-hydroxyphenyl,m-acetylphenol,3-hydroxy acetophenone,3-acetophenol PubChem CID: 8487 IUPAC Name: 1-(3-hydroxyphenyl)ethanone SMILES: CC(=O)C1=CC(=CC=C1)O

PubChem CID 8487
CAS 121-71-1
Molecular Weight (g/mol) 136.15
MDL Number MFCD00002298
SMILES CC(=O)C1=CC(=CC=C1)O
Synonym 3'-hydroxyacetophenone,3-hydroxyacetophenone,1-3-hydroxyphenyl ethanone,m-hydroxyacetophenone,3-acetylphenol,1-3-hydroxyphenyl ethan-1-one,ethanone, 1-3-hydroxyphenyl,m-acetylphenol,3-hydroxy acetophenone,3-acetophenol
IUPAC Name 1-(3-hydroxyphenyl)ethanone
InChI Key LUJMEECXHPYQOF-UHFFFAOYSA-N
Molecular Formula C8H8O2
90
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2-Acetylbenzo[b]furan, 99%

CAS: 1646-26-0 Molecular Formula: C10H8O2 Molecular Weight (g/mol): 160.17 MDL Number: MFCD00005849 InChI Key: YUTFQTAITWWGFH-UHFFFAOYSA-N Synonym: 2-acetylbenzofuran,1-benzofuran-2-yl ethanone,ethanone, 1-2-benzofuranyl,benzofuran-2-yl methyl ketone,2-acetylcoumarone,2-acetylcumarone,2-benzofuranyl methyl ketone,benzo b furan-2-yl methyl ketone,1-2-benzofuranyl ethanone,2-acetylbenzo b furan PubChem CID: 15435 SMILES: CC(=O)C1=CC2=CC=CC=C2O1

PubChem CID 15435
CAS 1646-26-0
Molecular Weight (g/mol) 160.17
MDL Number MFCD00005849
SMILES CC(=O)C1=CC2=CC=CC=C2O1
Synonym 2-acetylbenzofuran,1-benzofuran-2-yl ethanone,ethanone, 1-2-benzofuranyl,benzofuran-2-yl methyl ketone,2-acetylcoumarone,2-acetylcumarone,2-benzofuranyl methyl ketone,benzo b furan-2-yl methyl ketone,1-2-benzofuranyl ethanone,2-acetylbenzo b furan
InChI Key YUTFQTAITWWGFH-UHFFFAOYSA-N
Molecular Formula C10H8O2