Alpha beta-unsaturated carbonyl compounds

Organic compounds consisting of an alkene (carbon - carbon double bond) adjacent to a ketone functional group; also known as an enone.

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121 – 135 of 347 results

121

Ethyl 2-Acetyl-3-ethoxyacrylate 98.0+%, TCI America™

CAS: 3788-94-1 Molecular Formula: C9H14O4 Molecular Weight (g/mol): 186.207 MDL Number: MFCD06797311 InChI Key: FNASCUBBFNCFQO-VURMDHGXSA-N Synonym: 2-Acetyl-3-ethoxyacrylic Acid Ethyl Ester PubChem CID: 5355337 IUPAC Name: ethyl (2Z)-2-(ethoxymethylidene)-3-oxobutanoate SMILES: CCOC=C(C(=O)C)C(=O)OCC

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Specifications

PubChem CID	5355337
CAS	3788-94-1
Molecular Weight (g/mol)	186.207
MDL Number	MFCD06797311
SMILES	CCOC=C(C(=O)C)C(=O)OCC
Synonym	2-Acetyl-3-ethoxyacrylic Acid Ethyl Ester
IUPAC Name	ethyl (2Z)-2-(ethoxymethylidene)-3-oxobutanoate
InChI Key	FNASCUBBFNCFQO-VURMDHGXSA-N
Molecular Formula	C9H14O4

122

2,4-Heptadien-6-one (stabilized with HQ) 95.0+%, TCI America™

CAS: 3916-64-1 Molecular Formula: C7H10O Molecular Weight (g/mol): 110.156 MDL Number: MFCD00059238 InChI Key: SWGLACWOVFCDQS-VNKDHWASSA-N Synonym: 5-Acetyl-2,4-pentadiene PubChem CID: 643537 IUPAC Name: (3E,5E)-hepta-3,5-dien-2-one SMILES: CC=CC=CC(=O)C

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Specifications

PubChem CID	643537
CAS	3916-64-1
Molecular Weight (g/mol)	110.156
MDL Number	MFCD00059238
SMILES	CC=CC=CC(=O)C
Synonym	5-Acetyl-2,4-pentadiene
IUPAC Name	(3E,5E)-hepta-3,5-dien-2-one
InChI Key	SWGLACWOVFCDQS-VNKDHWASSA-N
Molecular Formula	C7H10O

123

(1R,2R)-N,N'-Bis(2-acetyl-3-oxo-2-butenylidene)-1,2-dimesitylethylenediaminato Cobalt(II), TCI America™

CAS: 361346-80-7 Molecular Formula: C32H40CoN2O4 Molecular Weight (g/mol): 575.615 MDL Number: MFCD06797061 InChI Key: WDSKJOXWWBKMGO-JOVGIXRXSA-N Synonym: (R)-AMAC PubChem CID: 11226930 IUPAC Name: 3-[[[(1R,2R)-2-[(2-acetyl-3-oxobut-1-enyl)amino]-1,2-bis(2,4,6-trimethylphenyl)ethyl]amino]methylidene]pentane-2,4-dione;cobalt SMILES: CC1=CC(=C(C(=C1)C)C(C(C2=C(C=C(C=C2C)C)C)NC=C(C(=O)C)C(=O)C)NC=C(C(=O)C)C(=O)C)C.[Co]

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PubChem CID	11226930
CAS	361346-80-7
Molecular Weight (g/mol)	575.615
MDL Number	MFCD06797061
SMILES	CC1=CC(=C(C(=C1)C)C(C(C2=C(C=C(C=C2C)C)C)NC=C(C(=O)C)C(=O)C)NC=C(C(=O)C)C(=O)C)C.[Co]
Synonym	(R)-AMAC
IUPAC Name	3-[[[(1R,2R)-2-[(2-acetyl-3-oxobut-1-enyl)amino]-1,2-bis(2,4,6-trimethylphenyl)ethyl]amino]methylidene]pentane-2,4-dione;cobalt
InChI Key	WDSKJOXWWBKMGO-JOVGIXRXSA-N
Molecular Formula	C32H40CoN2O4

124

3-Dimethylamino-2-methyl-2-propenal 97.0+%, TCI America™

CAS: 19125-76-9 Molecular Formula: C6H11NO Molecular Weight (g/mol): 113.16 MDL Number: MFCD00075471 InChI Key: JGAMOQYFDMQPRJ-XQRVVYSFSA-N Synonym: z-3-dimethylamino-2-methylacrylaldehyde,2z-3-dimethylamino-2-methylacrylaldehyde,2z-3-dimethylamino-2-methylprop-2-enal,z-3-dimethylamino-2-methylprop-2-enal,2-propenal, 3-dimethylamino-2-methyl-, z,2-propenal, 3-dimethylamino-2-methyl-, 2z PubChem CID: 5919306 IUPAC Name: (Z)-3-(dimethylamino)-2-methylprop-2-enal SMILES: CC(=CN(C)C)C=O

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Specifications

PubChem CID	5919306
CAS	19125-76-9
Molecular Weight (g/mol)	113.16
MDL Number	MFCD00075471
SMILES	CC(=CN(C)C)C=O
Synonym	z-3-dimethylamino-2-methylacrylaldehyde,2z-3-dimethylamino-2-methylacrylaldehyde,2z-3-dimethylamino-2-methylprop-2-enal,z-3-dimethylamino-2-methylprop-2-enal,2-propenal, 3-dimethylamino-2-methyl-, z,2-propenal, 3-dimethylamino-2-methyl-, 2z
IUPAC Name	(Z)-3-(dimethylamino)-2-methylprop-2-enal
InChI Key	JGAMOQYFDMQPRJ-XQRVVYSFSA-N
Molecular Formula	C6H11NO

125

Bis(2,4-pentanedionato)manganese(II) Dihydrate 97.0+%, TCI America™

CAS: 14024-58-9 Molecular Formula: C10H14MnO4 Molecular Weight (g/mol): 253.16 MDL Number: MFCD00000022 MFCD09998212 InChI Key: ZQZQURFYFJBOCE-FDGPNNRMSA-L Synonym: bis 4-hydroxypent-3-en-2-one dihydrate manganese PubChem CID: 54669727 IUPAC Name: manganese(2+) bis((2Z)-4-oxopent-2-en-2-olate) SMILES: [Mn++].C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O

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Specifications

PubChem CID	54669727
CAS	14024-58-9
Molecular Weight (g/mol)	253.16
MDL Number	MFCD00000022 MFCD09998212
SMILES	[Mn++].C\C([O-])=C\C(C)=O.C\C([O-])=C\C(C)=O
Synonym	bis 4-hydroxypent-3-en-2-one dihydrate manganese
IUPAC Name	manganese(2+) bis((2Z)-4-oxopent-2-en-2-olate)
InChI Key	ZQZQURFYFJBOCE-FDGPNNRMSA-L
Molecular Formula	C10H14MnO4

126

Bis(hexafluoroacetylacetonato)copper(II) Hydrate 95.0+%, TCI America™

CAS: 14781-45-4 Molecular Formula: C10H4CuF12O5 Molecular Weight (g/mol): 495.664 MDL Number: MFCD00064754 InChI Key: SREVICRJIZZXHD-SUXDNRKISA-L Synonym: Copper(II) Hexafluoroacetylacetonate, Hexafluoroacetylacetono Copper(II) Salt PubChem CID: 15860928 IUPAC Name: copper;(Z)-1,1,1,5,5,5-hexafluoro-4-oxopent-2-en-2-olate;hydrate SMILES: C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.O.[Cu+2]

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Specifications

PubChem CID	15860928
CAS	14781-45-4
Molecular Weight (g/mol)	495.664
MDL Number	MFCD00064754
SMILES	C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.C(=C(C(F)(F)F)[O-])C(=O)C(F)(F)F.O.[Cu+2]
Synonym	Copper(II) Hexafluoroacetylacetonate, Hexafluoroacetylacetono Copper(II) Salt
IUPAC Name	copper;(Z)-1,1,1,5,5,5-hexafluoro-4-oxopent-2-en-2-olate;hydrate
InChI Key	SREVICRJIZZXHD-SUXDNRKISA-L
Molecular Formula	C10H4CuF12O5

127

Bis(2,4-pentanedionato)magnesium(II) 98.0+%, TCI America™

CAS: 14024-56-7 Molecular Formula: C10H14MgO4 Molecular Weight (g/mol): 222.523 MDL Number: MFCD00013497 InChI Key: AKTIAGQCYPCKFX-SYWGCQIGSA-L Synonym: 4-4-oxopent-2-en-2-yl oxy magnesio oxy pent-3-en-2-one PubChem CID: 25113476 IUPAC Name: magnesium;(E)-4-oxopent-2-en-2-olate SMILES: CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].[Mg+2]

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Specifications

PubChem CID	25113476
CAS	14024-56-7
Molecular Weight (g/mol)	222.523
MDL Number	MFCD00013497
SMILES	CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].[Mg+2]
Synonym	4-4-oxopent-2-en-2-yl oxy magnesio oxy pent-3-en-2-one
IUPAC Name	magnesium;(E)-4-oxopent-2-en-2-olate
InChI Key	AKTIAGQCYPCKFX-SYWGCQIGSA-L
Molecular Formula	C10H14MgO4

128

4-(3-Aminophenyl)-2-methyl-3-butyn-2-ol 98.0+%, TCI America™

CAS: 69088-96-6 Molecular Formula: C11H13NO Molecular Weight (g/mol): 175.231 MDL Number: MFCD06200785 InChI Key: DQPSETABKZMTEZ-UHFFFAOYSA-N Synonym: 3-(3-Hydroxy-3-methyl-1-butyn-1-yl)aniline PubChem CID: 112236 IUPAC Name: 4-(3-aminophenyl)-2-methylbut-3-yn-2-ol SMILES: CC(C)(C#CC1=CC(=CC=C1)N)O

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Specifications

PubChem CID	112236
CAS	69088-96-6
Molecular Weight (g/mol)	175.231
MDL Number	MFCD06200785
SMILES	CC(C)(C#CC1=CC(=CC=C1)N)O
Synonym	3-(3-Hydroxy-3-methyl-1-butyn-1-yl)aniline
IUPAC Name	4-(3-aminophenyl)-2-methylbut-3-yn-2-ol
InChI Key	DQPSETABKZMTEZ-UHFFFAOYSA-N
Molecular Formula	C11H13NO

129

3-Methyl-3-buten-2-one (stabilized with HQ) 95.0+%, TCI America™

CAS: 814-78-8 Molecular Formula: C5H8O Molecular Weight (g/mol): 84.118 MDL Number: MFCD00059207 InChI Key: ZGHFDIIVVIFNPS-UHFFFAOYSA-N Synonym: Isopropenyl Methyl Ketone PubChem CID: 13143 IUPAC Name: 3-methylbut-3-en-2-one SMILES: CC(=C)C(=O)C

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PubChem CID	13143
CAS	814-78-8
Molecular Weight (g/mol)	84.118
MDL Number	MFCD00059207
SMILES	CC(=C)C(=O)C
Synonym	Isopropenyl Methyl Ketone
IUPAC Name	3-methylbut-3-en-2-one
InChI Key	ZGHFDIIVVIFNPS-UHFFFAOYSA-N
Molecular Formula	C5H8O

130

2,5-Dimethyl-3-hexyne-2,5-diol 99.0+%, TCI America™

CAS: 142-30-3 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.198 MDL Number: MFCD00004468 InChI Key: IHJUECRFYCQBMW-UHFFFAOYSA-N Synonym: 2,5-dimethyl-3-hexyne-2,5-diol,dimethylhexynediol,kemitracin-50,tetramethylbutynediol,acetylenepinacol,3-hexyne-2,5-diol, 2,5-dimethyl,olfine y,tetramethyl-2-butynediol,unii-22rr53u71w,2,5-dimethylhexyne-2,5-diol PubChem CID: 8883 IUPAC Name: 2,5-dimethylhex-3-yne-2,5-diol SMILES: CC(C)(C#CC(C)(C)O)O

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Specifications

PubChem CID	8883
CAS	142-30-3
Molecular Weight (g/mol)	142.198
MDL Number	MFCD00004468
SMILES	CC(C)(C#CC(C)(C)O)O
Synonym	2,5-dimethyl-3-hexyne-2,5-diol,dimethylhexynediol,kemitracin-50,tetramethylbutynediol,acetylenepinacol,3-hexyne-2,5-diol, 2,5-dimethyl,olfine y,tetramethyl-2-butynediol,unii-22rr53u71w,2,5-dimethylhexyne-2,5-diol
IUPAC Name	2,5-dimethylhex-3-yne-2,5-diol
InChI Key	IHJUECRFYCQBMW-UHFFFAOYSA-N
Molecular Formula	C8H14O2

131

3-(Dimethylamino)acrolein 98.0+%, TCI America™

CAS: 927-63-9 Molecular Formula: C5H9NO Molecular Weight (g/mol): 99.13 MDL Number: MFCD00006999 InChI Key: RRLMPLDPCKRASL-ONEGZZNKSA-N Synonym: 3-dimethylaminoacrolein,3-dimethylaminoacrylaldehyde,3-dimethylamino acrylaldehyde,3-dimethylamino acrolein,2-propenal, 3-dimethylamino,e-3-dimethylamino acrylaldehyde,e-3-dimethylamino prop-2-enal,3-dimethylamino propenal,2e-3-dimethylamino prop-2-enal,.beta.-dimethylamino acrolein PubChem CID: 638320 IUPAC Name: (2E)-3-(dimethylamino)prop-2-enal SMILES: CN(C)\C=C\C=O

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PubChem CID	638320
CAS	927-63-9
Molecular Weight (g/mol)	99.13
MDL Number	MFCD00006999
SMILES	CN(C)\C=C\C=O
Synonym	3-dimethylaminoacrolein,3-dimethylaminoacrylaldehyde,3-dimethylamino acrylaldehyde,3-dimethylamino acrolein,2-propenal, 3-dimethylamino,e-3-dimethylamino acrylaldehyde,e-3-dimethylamino prop-2-enal,3-dimethylamino propenal,2e-3-dimethylamino prop-2-enal,.beta.-dimethylamino acrolein
IUPAC Name	(2E)-3-(dimethylamino)prop-2-enal
InChI Key	RRLMPLDPCKRASL-ONEGZZNKSA-N
Molecular Formula	C5H9NO

132

Efavirenz 98.0+%, TCI America™

CAS: 154598-52-4 Molecular Formula: C14H9ClF3NO2 Molecular Weight (g/mol): 315.676 MDL Number: MFCD05662344 InChI Key: XPOQHMRABVBWPR-ZDUSSCGKSA-N Synonym: (4S)-6-Chloro-4-(2-cyclopropylethynyl)-1,4-dihydro-4-(trifluoromethyl)-2H-3,1-benzoxazin-2-one PubChem CID: 64139 ChEBI: CHEBI:119486 IUPAC Name: (4S)-6-chloro-4-(2-cyclopropylethynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one SMILES: C1CC1C#CC2(C3=C(C=CC(=C3)Cl)NC(=O)O2)C(F)(F)F

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Specifications

PubChem CID	64139
CAS	154598-52-4
Molecular Weight (g/mol)	315.676
ChEBI	CHEBI:119486
MDL Number	MFCD05662344
SMILES	C1CC1C#CC2(C3=C(C=CC(=C3)Cl)NC(=O)O2)C(F)(F)F
Synonym	(4S)-6-Chloro-4-(2-cyclopropylethynyl)-1,4-dihydro-4-(trifluoromethyl)-2H-3,1-benzoxazin-2-one
IUPAC Name	(4S)-6-chloro-4-(2-cyclopropylethynyl)-4-(trifluoromethyl)-1H-3,1-benzoxazin-2-one
InChI Key	XPOQHMRABVBWPR-ZDUSSCGKSA-N
Molecular Formula	C14H9ClF3NO2

133

Ethyl 2-(Ethoxymethylene)-4,4,4-trifluoro-3-oxobutyrate 96.0+%, TCI America™

CAS: 571-55-1 Molecular Formula: C9H11F3O4 Molecular Weight (g/mol): 240.178 MDL Number: MFCD02677683 InChI Key: XNGGOXOLHQANRB-AATRIKPKSA-N Synonym: ethyl ethoxymethylene-3-oxo-4,4,4-trifluorobutyrate,ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutyrate,e-ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutanoate,ethyl 2-ethoxymethylene-4,4,4-trifluoroacetoacetate,ethyl 2e-2-ethoxymethylidene-4,4,4-trifluoro-3-oxobutanoate,ethyl 2-ethoxymethylidene-4,4,4-trifluoro-3-oxobutanoate,ethyl ethoxymethylene-3-oxo-4,4,4-trifluoro-butyrate,ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutanoate,ethyl 2e-3-ethoxy-2-2,2,2-trifluoroacetyl prop-2-enoate,2e-2-ethoxymethylidene-4,4,4-trifluoro-3-oxobutanoic acid ethyl ester PubChem CID: 6185754 IUPAC Name: ethyl (2E)-2-(ethoxymethylidene)-4,4,4-trifluoro-3-oxobutanoate SMILES: CCOC=C(C(=O)C(F)(F)F)C(=O)OCC

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Specifications

PubChem CID	6185754
CAS	571-55-1
Molecular Weight (g/mol)	240.178
MDL Number	MFCD02677683
SMILES	CCOC=C(C(=O)C(F)(F)F)C(=O)OCC
Synonym	ethyl ethoxymethylene-3-oxo-4,4,4-trifluorobutyrate,ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutyrate,e-ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutanoate,ethyl 2-ethoxymethylene-4,4,4-trifluoroacetoacetate,ethyl 2e-2-ethoxymethylidene-4,4,4-trifluoro-3-oxobutanoate,ethyl 2-ethoxymethylidene-4,4,4-trifluoro-3-oxobutanoate,ethyl ethoxymethylene-3-oxo-4,4,4-trifluoro-butyrate,ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutanoate,ethyl 2e-3-ethoxy-2-2,2,2-trifluoroacetyl prop-2-enoate,2e-2-ethoxymethylidene-4,4,4-trifluoro-3-oxobutanoic acid ethyl ester
IUPAC Name	ethyl (2E)-2-(ethoxymethylidene)-4,4,4-trifluoro-3-oxobutanoate
InChI Key	XNGGOXOLHQANRB-AATRIKPKSA-N
Molecular Formula	C9H11F3O4

134

Copper(I) Hexafluoro-2,4-pentanedionate 1,5-Cyclooctadiene Complex 95.0+%, TCI America™

CAS: 86233-74-1 Molecular Formula: C13H14CuF6O2 Molecular Weight (g/mol): 379.79 MDL Number: MFCD00156517 InChI Key: WSAPIYREFIKPSH-OJKFPHAYSA-N Synonym: copper i hexafluoro-2,4-pentanedionate-cyclooctadiene complex,copper i hexafluoroacetylacetonate cyclooctadiene complex PubChem CID: 92043567 IUPAC Name: (1Z,5Z)-cycloocta-1,5-diene (3Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one copper SMILES: [Cu].C1C\C=C/CC\C=C/1.O\C(=C/C(=O)C(F)(F)F)C(F)(F)F

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Specifications

PubChem CID	92043567
CAS	86233-74-1
Molecular Weight (g/mol)	379.79
MDL Number	MFCD00156517
SMILES	[Cu].C1C\C=C/CC\C=C/1.O\C(=C/C(=O)C(F)(F)F)C(F)(F)F
Synonym	copper i hexafluoro-2,4-pentanedionate-cyclooctadiene complex,copper i hexafluoroacetylacetonate cyclooctadiene complex
IUPAC Name	(1Z,5Z)-cycloocta-1,5-diene (3Z)-1,1,1,5,5,5-hexafluoro-4-hydroxypent-3-en-2-one copper
InChI Key	WSAPIYREFIKPSH-OJKFPHAYSA-N
Molecular Formula	C13H14CuF6O2

135

Bis(2,4-pentanedionato)calcium(II) 98.0+%, TCI America™

CAS: 19372-44-2 Molecular Formula: C10H18CaO6 Molecular Weight (g/mol): 274.326 MDL Number: MFCD00013486 InChI Key: FTDUGYDPOWCKTD-VGKOASNMSA-L Synonym: Acetylacetone Calcium(II) Salt, Calcium(II) Acetylacetonate PubChem CID: 131675864 IUPAC Name: calcium;(Z)-4-oxopent-2-en-2-olate;dihydrate SMILES: CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].O.O.[Ca+2]

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Specifications

PubChem CID	131675864
CAS	19372-44-2
Molecular Weight (g/mol)	274.326
MDL Number	MFCD00013486
SMILES	CC(=CC(=O)C)[O-].CC(=CC(=O)C)[O-].O.O.[Ca+2]
Synonym	Acetylacetone Calcium(II) Salt, Calcium(II) Acetylacetonate
IUPAC Name	calcium;(Z)-4-oxopent-2-en-2-olate;dihydrate
InChI Key	FTDUGYDPOWCKTD-VGKOASNMSA-L
Molecular Formula	C10H18CaO6

Alpha beta-unsaturated carbonyl compounds

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