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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 Ketones (2,365)
Complex Aldehydes (1,275)
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Alpha beta-unsaturated carbonyl compounds (302)
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D-(+)-Maltose Monohydrate, Fisher BioReagents

CAS: 6363-53-7 Molecular Formula: C12H24O12 Molecular Weight (g/mol): 360.31 MDL Number: MFCD00149343 InChI Key: HBDJFVFTHLOSDW-UHFFFAOYNA-N Synonym: d-+-maltose monohydrate,unii-dm477ee40d,2r,3r,4r,5r-2,3,5,6-tetrahydroxy-4-2r,3r,4s,5s,6r-3,4,5-trihydroxy-6-hydroxymethyl oxan-2-yl oxy hexanal hydrate,beta-maltose monohydrate,d-+-maltosemonohydrate,69-79-4 anhydrous,d +-maltose monohydrate,d-+-maltose monohydrate, puriss.,d-+-maltose monohydrate, analytical standard,d-+-maltose monohydrate, bioxtra IUPAC Name: 2,3,5,6-tetrahydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexanal hydrate SMILES: O.OCC(O)C(OC1OC(CO)C(O)C(O)C1O)C(O)C(O)C=O

CAS 6363-53-7
Molecular Weight (g/mol) 360.31
MDL Number MFCD00149343
SMILES O.OCC(O)C(OC1OC(CO)C(O)C(O)C1O)C(O)C(O)C=O
Synonym d-+-maltose monohydrate,unii-dm477ee40d,2r,3r,4r,5r-2,3,5,6-tetrahydroxy-4-2r,3r,4s,5s,6r-3,4,5-trihydroxy-6-hydroxymethyl oxan-2-yl oxy hexanal hydrate,beta-maltose monohydrate,d-+-maltosemonohydrate,69-79-4 anhydrous,d +-maltose monohydrate,d-+-maltose monohydrate, puriss.,d-+-maltose monohydrate, analytical standard,d-+-maltose monohydrate, bioxtra
IUPAC Name 2,3,5,6-tetrahydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexanal hydrate
InChI Key HBDJFVFTHLOSDW-UHFFFAOYNA-N
Molecular Formula C12H24O12
2

2,2-Dimethyl-2,3-dihydro-1-benzofuran-7-carbaldehyde, 97%, Thermo Scientific™

CAS: 38002-88-9 Molecular Formula: C11H12O2 Molecular Weight (g/mol): 176.22 MDL Number: MFCD04115387 InChI Key: HGKYVFOYQUSRQN-UHFFFAOYSA-N Synonym: 2,2-dimethyl-2,3-dihydro-1-benzofuran-7-carbaldehyde,2,2-dimethyl-2,3-dihydrobenzofuran-7-carbaldehyde,7-benzofurancarboxaldehyde, 2,3-dihydro-2,2-dimethyl,2,2-dimethyl-7-formyl-2,3-dihydrobenzofuran,2,2-dimethyl-2,3-dihydro-benzofuran-7-carbaldehyde,2,3-dihydro-2,2-dimethylbenzofuran-7-carbaldehyde,2,2-dimethyl-2,3-dihydrobenzo b furan-7-carbaldehyde,2,3-dihydro-2,2-dimethylbenzofuran-7-carboxaldehyde,2,2-dimethyl-2,3-dihydro-1-benzo b furan-7-carbaldehyde PubChem CID: 2795471 SMILES: CC1(C)CC2=CC=CC(C=O)=C2O1

PubChem CID 2795471
CAS 38002-88-9
Molecular Weight (g/mol) 176.22
MDL Number MFCD04115387
SMILES CC1(C)CC2=CC=CC(C=O)=C2O1
Synonym 2,2-dimethyl-2,3-dihydro-1-benzofuran-7-carbaldehyde,2,2-dimethyl-2,3-dihydrobenzofuran-7-carbaldehyde,7-benzofurancarboxaldehyde, 2,3-dihydro-2,2-dimethyl,2,2-dimethyl-7-formyl-2,3-dihydrobenzofuran,2,2-dimethyl-2,3-dihydro-benzofuran-7-carbaldehyde,2,3-dihydro-2,2-dimethylbenzofuran-7-carbaldehyde,2,2-dimethyl-2,3-dihydrobenzo b furan-7-carbaldehyde,2,3-dihydro-2,2-dimethylbenzofuran-7-carboxaldehyde,2,2-dimethyl-2,3-dihydro-1-benzo b furan-7-carbaldehyde
InChI Key HGKYVFOYQUSRQN-UHFFFAOYSA-N
Molecular Formula C11H12O2
5

Ethacrynic acid

CAS: 58-54-8 Molecular Formula: C13H12Cl2O4 Molecular Weight (g/mol): 303.135 MDL Number: MFCD00056693 InChI Key: AVOLMBLBETYQHX-UHFFFAOYSA-N Synonym: ethacrynic acid,etacrynic acid,ethacrynate,etacrinic acid,hydromedin,edecrin,crinuryl,edecril,edecrina,endecril PubChem CID: 3278 ChEBI: CHEBI:4876 IUPAC Name: 2-[2,3-dichloro-4-(2-methylidenebutanoyl)phenoxy]acetic acid SMILES: CCC(=C)C(=O)C1=C(C(=C(C=C1)OCC(=O)O)Cl)Cl

PubChem CID 3278
CAS 58-54-8
Molecular Weight (g/mol) 303.135
ChEBI CHEBI:4876
MDL Number MFCD00056693
SMILES CCC(=C)C(=O)C1=C(C(=C(C=C1)OCC(=O)O)Cl)Cl
Synonym ethacrynic acid,etacrynic acid,ethacrynate,etacrinic acid,hydromedin,edecrin,crinuryl,edecril,edecrina,endecril
IUPAC Name 2-[2,3-dichloro-4-(2-methylidenebutanoyl)phenoxy]acetic acid
InChI Key AVOLMBLBETYQHX-UHFFFAOYSA-N
Molecular Formula C13H12Cl2O4
6

Acebutolol hydrochloride

CAS: 34381-68-5 Molecular Formula: C18H29ClN2O4 Molecular Weight (g/mol): 372.89 MDL Number: MFCD00078860 InChI Key: KTUFKADDDORSSI-UHFFFAOYNA-N Synonym: acebutolol hydrochloride,acebutolol hcl,n-3-acetyl-4-2-hydroxy-3-isopropylamino propoxy phenyl butyramide hydrochloride,diasectral,wesfalin,3'-acetyl-4'-2-hydroxy-3-isopropylamino propoxy butyranilide hydrochloride,dl-1-2-acetyl-4-butyramidophenoxy-2-hydroxy-3-isopropylaminopropane hydrochloride,ccris 1102,sectral tn PubChem CID: 441307 ChEBI: CHEBI:2380 IUPAC Name: hydrogen N-(3-acetyl-4-{2-hydroxy-3-[(propan-2-yl)amino]propoxy}phenyl)butanamide chloride SMILES: [H+].[Cl-].CCCC(=O)NC1=CC=C(OCC(O)CNC(C)C)C(=C1)C(C)=O

PubChem CID 441307
CAS 34381-68-5
Molecular Weight (g/mol) 372.89
ChEBI CHEBI:2380
MDL Number MFCD00078860
SMILES [H+].[Cl-].CCCC(=O)NC1=CC=C(OCC(O)CNC(C)C)C(=C1)C(C)=O
Synonym acebutolol hydrochloride,acebutolol hcl,n-3-acetyl-4-2-hydroxy-3-isopropylamino propoxy phenyl butyramide hydrochloride,diasectral,wesfalin,3'-acetyl-4'-2-hydroxy-3-isopropylamino propoxy butyranilide hydrochloride,dl-1-2-acetyl-4-butyramidophenoxy-2-hydroxy-3-isopropylaminopropane hydrochloride,ccris 1102,sectral tn
IUPAC Name hydrogen N-(3-acetyl-4-{2-hydroxy-3-[(propan-2-yl)amino]propoxy}phenyl)butanamide chloride
InChI Key KTUFKADDDORSSI-UHFFFAOYNA-N
Molecular Formula C18H29ClN2O4
7

Dexamethasone 21-phosphate disodium salt, 98%

CAS: 2392-39-4 Molecular Formula: C22H28FNa2O8P Molecular Weight (g/mol): 516.41 MDL Number: MFCD00079105 InChI Key: PLCQGRYPOISRTQ-FCJDYXGNSA-L Synonym: dexamethasone sodium phosphate,dexamethasone 21-phosphate disodium salt,dalalone,dexadreson,dexagro,megacort,soldesam,spersadox,decdan,solu-decadron PubChem CID: 16961 ChEBI: CHEBI:4462 IUPAC Name: disodium;[2-[(8S,9R,10S,11S,13S,14S,16R,17R)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] phosphate SMILES: CC1CC2C3CCC4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)COP(=O)([O-])[O-])O)C)O)F)C.[Na+].[Na+]

PubChem CID 16961
CAS 2392-39-4
Molecular Weight (g/mol) 516.41
ChEBI CHEBI:4462
MDL Number MFCD00079105
SMILES CC1CC2C3CCC4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)COP(=O)([O-])[O-])O)C)O)F)C.[Na+].[Na+]
Synonym dexamethasone sodium phosphate,dexamethasone 21-phosphate disodium salt,dalalone,dexadreson,dexagro,megacort,soldesam,spersadox,decdan,solu-decadron
IUPAC Name disodium;[2-[(8S,9R,10S,11S,13S,14S,16R,17R)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] phosphate
InChI Key PLCQGRYPOISRTQ-FCJDYXGNSA-L
Molecular Formula C22H28FNa2O8P
8

Pifithrin-alpha, p-Nitro hydrobromide, Thermo Scientific Chemicals

CAS: 389850-21-9 Molecular Formula: C15H16BrN3O3S Molecular Weight (g/mol): 398.275 MDL Number: MFCD00398180 InChI Key: NXPCMOGORSWOLH-UHFFFAOYSA-N Synonym: pifithrin-alpha, p-nitro,1-4-nitrophenyl-2-4,5,6,7-tetrahydro-2-imino-3 2h-benzothiazolyl ethanone, hbr,pifithrin-alpha, p-nitro hydrobromide,2-2-imino-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl-1-4-nitrophenyl ethanone hydrobromide,2-2-imino-4,5,6,7-tetrahydrobenzo d thiazol-3 2h-yl-1-4-nitrophenyl ethanone hbr,2-2-imino-4,5,6,7-tetrahydrobenzo d thiazol-3 2h-yl-1-4-nitrophenyl ethanone hydrobromide PubChem CID: 11553038 IUPAC Name: 2-(2-imino-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl)-1-(4-nitrophenyl)ethanone;hydrobromide SMILES: C1CCC2=C(C1)N(C(=N)S2)CC(=O)C3=CC=C(C=C3)[N+](=O)[O-].Br

PubChem CID 11553038
CAS 389850-21-9
Molecular Weight (g/mol) 398.275
MDL Number MFCD00398180
SMILES C1CCC2=C(C1)N(C(=N)S2)CC(=O)C3=CC=C(C=C3)[N+](=O)[O-].Br
Synonym pifithrin-alpha, p-nitro,1-4-nitrophenyl-2-4,5,6,7-tetrahydro-2-imino-3 2h-benzothiazolyl ethanone, hbr,pifithrin-alpha, p-nitro hydrobromide,2-2-imino-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl-1-4-nitrophenyl ethanone hydrobromide,2-2-imino-4,5,6,7-tetrahydrobenzo d thiazol-3 2h-yl-1-4-nitrophenyl ethanone hbr,2-2-imino-4,5,6,7-tetrahydrobenzo d thiazol-3 2h-yl-1-4-nitrophenyl ethanone hydrobromide
IUPAC Name 2-(2-imino-4,5,6,7-tetrahydro-1,3-benzothiazol-3-yl)-1-(4-nitrophenyl)ethanone;hydrobromide
InChI Key NXPCMOGORSWOLH-UHFFFAOYSA-N
Molecular Formula C15H16BrN3O3S
9

4-Acetyl-N-methylaniline, 97%

CAS: 17687-47-7 Molecular Formula: C9H11NO Molecular Weight (g/mol): 149.19 MDL Number: MFCD09261160 InChI Key: GDBAYICEBDZUNM-UHFFFAOYSA-N Synonym: 4-acetyl-n-methylaniline,1-4-methylamino phenyl ethanone,4-acetyl-n-methyl aniline,1-4-methylamino phenyl ethan-1-one,1-4-methylamino-phenyl-ethanone,ethanone, 1-4-methylamino phenyl,n-methyl-4-acetylaniline,acmc-1brn7,4-n-methylaminoacetophenone PubChem CID: 11607936 IUPAC Name: 1-[4-(methylamino)phenyl]ethanone SMILES: CNC1=CC=C(C=C1)C(C)=O

PubChem CID 11607936
CAS 17687-47-7
Molecular Weight (g/mol) 149.19
MDL Number MFCD09261160
SMILES CNC1=CC=C(C=C1)C(C)=O
Synonym 4-acetyl-n-methylaniline,1-4-methylamino phenyl ethanone,4-acetyl-n-methyl aniline,1-4-methylamino phenyl ethan-1-one,1-4-methylamino-phenyl-ethanone,ethanone, 1-4-methylamino phenyl,n-methyl-4-acetylaniline,acmc-1brn7,4-n-methylaminoacetophenone
IUPAC Name 1-[4-(methylamino)phenyl]ethanone
InChI Key GDBAYICEBDZUNM-UHFFFAOYSA-N
Molecular Formula C9H11NO
10

3,3-Dimethylbutyraldehyde, 97%

CAS: 2987-16-8 Molecular Formula: C6H12O Molecular Weight (g/mol): 100.161 MDL Number: MFCD00042807 InChI Key: LTNUSYNQZJZUSY-UHFFFAOYSA-N Synonym: 3,3-dimethylbutyraldehyde,3,3-dimethyl-butyraldehyde,butanal, 3,3-dimethyl,unii-cam6hd7jki,tert-butylacetaldehyde,3,3-dimethyl-butanal,cam6hd7jki,neohexal,pubchem3076,3,3-dimethylbutyraldehyd PubChem CID: 76335 IUPAC Name: 3,3-dimethylbutanal SMILES: CC(C)(C)CC=O

PubChem CID 76335
CAS 2987-16-8
Molecular Weight (g/mol) 100.161
MDL Number MFCD00042807
SMILES CC(C)(C)CC=O
Synonym 3,3-dimethylbutyraldehyde,3,3-dimethyl-butyraldehyde,butanal, 3,3-dimethyl,unii-cam6hd7jki,tert-butylacetaldehyde,3,3-dimethyl-butanal,cam6hd7jki,neohexal,pubchem3076,3,3-dimethylbutyraldehyd
IUPAC Name 3,3-dimethylbutanal
InChI Key LTNUSYNQZJZUSY-UHFFFAOYSA-N
Molecular Formula C6H12O
11

7-Chloroisatin, 97%

CAS: 7477-63-6 Molecular Formula: C8H4ClNO2 Molecular Weight (g/mol): 181.575 MDL Number: MFCD00022796 InChI Key: MPLXQMMMGDYXIT-UHFFFAOYSA-N PubChem CID: 344135 IUPAC Name: 7-chloro-1H-indole-2,3-dione SMILES: C1=CC2=C(C(=C1)Cl)NC(=O)C2=O

PubChem CID 344135
CAS 7477-63-6
Molecular Weight (g/mol) 181.575
MDL Number MFCD00022796
SMILES C1=CC2=C(C(=C1)Cl)NC(=O)C2=O
IUPAC Name 7-chloro-1H-indole-2,3-dione
InChI Key MPLXQMMMGDYXIT-UHFFFAOYSA-N
Molecular Formula C8H4ClNO2
12

4-Bromo-1-indanone, 97%

CAS: 15115-60-3 Molecular Formula: C9H7BrO Molecular Weight (g/mol): 211.06 MDL Number: MFCD01719772 InChI Key: UVVYFYLSZIMKMC-UHFFFAOYSA-N Synonym: 4-bromo-1-indanone,4-bromo-indan-1-one,4-bromoindan-1-one,4-bromo-2,3-dihydro-1h-inden-1-one,1-indanone, 4-bromo,4-bromohydrindone-1,1h-inden-1-one, 4-bromo-2,3-dihydro,4-bromoindanone,4-bromo indanone,4-bromo-indanone PubChem CID: 98713 IUPAC Name: 4-bromo-2,3-dihydroinden-1-one SMILES: BrC1=CC=CC2=C1CCC2=O

PubChem CID 98713
CAS 15115-60-3
Molecular Weight (g/mol) 211.06
MDL Number MFCD01719772
SMILES BrC1=CC=CC2=C1CCC2=O
Synonym 4-bromo-1-indanone,4-bromo-indan-1-one,4-bromoindan-1-one,4-bromo-2,3-dihydro-1h-inden-1-one,1-indanone, 4-bromo,4-bromohydrindone-1,1h-inden-1-one, 4-bromo-2,3-dihydro,4-bromoindanone,4-bromo indanone,4-bromo-indanone
IUPAC Name 4-bromo-2,3-dihydroinden-1-one
InChI Key UVVYFYLSZIMKMC-UHFFFAOYSA-N
Molecular Formula C9H7BrO
13

3-Allylsalicylaldehyde, 97%

CAS: 24019-66-7 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.188 MDL Number: MFCD00037364 InChI Key: INLWEXRRMUMHKB-UHFFFAOYSA-N Synonym: 3-allyl-2-hydroxybenzaldehyde,3-allylsalicylaldehyde,3-allyl-2-hydroxy-benzaldehyde,benzaldehyde, 2-hydroxy-3-2-propenyl,salicylaldehyde, 3-allyl,2-hydroxy-3-prop-2-en-1-yl benzaldehyde,acmc-209wev,tpc-sk001,2-hydroxy-3-allylbenzaldehyde PubChem CID: 141062 IUPAC Name: 2-hydroxy-3-prop-2-enylbenzaldehyde SMILES: C=CCC1=CC=CC(=C1O)C=O

PubChem CID 141062
CAS 24019-66-7
Molecular Weight (g/mol) 162.188
MDL Number MFCD00037364
SMILES C=CCC1=CC=CC(=C1O)C=O
Synonym 3-allyl-2-hydroxybenzaldehyde,3-allylsalicylaldehyde,3-allyl-2-hydroxy-benzaldehyde,benzaldehyde, 2-hydroxy-3-2-propenyl,salicylaldehyde, 3-allyl,2-hydroxy-3-prop-2-en-1-yl benzaldehyde,acmc-209wev,tpc-sk001,2-hydroxy-3-allylbenzaldehyde
IUPAC Name 2-hydroxy-3-prop-2-enylbenzaldehyde
InChI Key INLWEXRRMUMHKB-UHFFFAOYSA-N
Molecular Formula C10H10O2
14

5,7-Difluoro-1-indanone, 97%

CAS: 84315-25-3 Molecular Formula: C9H6F2O Molecular Weight (g/mol): 168.14 MDL Number: MFCD09908161 InChI Key: XWZGNWCKXLECBO-UHFFFAOYSA-N Synonym: 5,7-difluoro-1-indanone,5,7-difluoro-2,3-dihydro-1h-inden-1-one,1h-inden-1-one, 5,7-difluoro-2,3-dihydro,5,7-difluoroindan-1-one,1h-inden-1-one,5,7-difluoro-2,3-dihydro,acmc-20a83k,5,7-difluoro-2,3-dihydro-1h-indene-1-one PubChem CID: 11789595 IUPAC Name: 5,7-difluoro-2,3-dihydroinden-1-one SMILES: FC1=CC(F)=C2C(=O)CCC2=C1

PubChem CID 11789595
CAS 84315-25-3
Molecular Weight (g/mol) 168.14
MDL Number MFCD09908161
SMILES FC1=CC(F)=C2C(=O)CCC2=C1
Synonym 5,7-difluoro-1-indanone,5,7-difluoro-2,3-dihydro-1h-inden-1-one,1h-inden-1-one, 5,7-difluoro-2,3-dihydro,5,7-difluoroindan-1-one,1h-inden-1-one,5,7-difluoro-2,3-dihydro,acmc-20a83k,5,7-difluoro-2,3-dihydro-1h-indene-1-one
IUPAC Name 5,7-difluoro-2,3-dihydroinden-1-one
InChI Key XWZGNWCKXLECBO-UHFFFAOYSA-N
Molecular Formula C9H6F2O
15

5,7-Dichloro-1-indanone, 97%

CAS: 448193-94-0 Molecular Formula: C9H6Cl2O Molecular Weight (g/mol): 201.05 MDL Number: MFCD09908160 InChI Key: TWNXYJNWNZZECV-UHFFFAOYSA-N Synonym: 5,7-dichloro-2,3-dihydro-1h-inden-1-one,5,7-dichloro-1-indanone,1h-inden-1-one, 5,7-dichloro-2,3-dihydro,5,7-dichloroindan-1-one,acmc-1asf2 PubChem CID: 22292346 SMILES: ClC1=CC(Cl)=C2C(=O)CCC2=C1

PubChem CID 22292346
CAS 448193-94-0
Molecular Weight (g/mol) 201.05
MDL Number MFCD09908160
SMILES ClC1=CC(Cl)=C2C(=O)CCC2=C1
Synonym 5,7-dichloro-2,3-dihydro-1h-inden-1-one,5,7-dichloro-1-indanone,1h-inden-1-one, 5,7-dichloro-2,3-dihydro,5,7-dichloroindan-1-one,acmc-1asf2
InChI Key TWNXYJNWNZZECV-UHFFFAOYSA-N
Molecular Formula C9H6Cl2O