Alpha-halocarboxylic acids and derivatives

Organic compounds that contain a carboxyl group bonded to a halogen group in the alpha position; halogen groups consist of one or more halogen atoms (F, Cl, B, I, At). Includes compounds that are derived from alpha-halocarboxylic acids.

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181 – 195 of 572 results

181

Ethyl Heptadecafluorononanoate 98.0+%, TCI America™

CAS: 30377-52-7 Molecular Formula: C11H5F17O2 Molecular Weight (g/mol): 492.13 MDL Number: MFCD00039245 InChI Key: DRLDSHOYANTUND-UHFFFAOYSA-N Synonym: Heptadecafluorononanoic Acid Ethyl Ester, Ethyl Perfluorononanoate, Perfluorononanoic Acid Ethyl Ester PubChem CID: 121681 IUPAC Name: ethyl 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononanoate SMILES: CCOC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

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Specifications

PubChem CID	121681
CAS	30377-52-7
Molecular Weight (g/mol)	492.13
MDL Number	MFCD00039245
SMILES	CCOC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
Synonym	Heptadecafluorononanoic Acid Ethyl Ester, Ethyl Perfluorononanoate, Perfluorononanoic Acid Ethyl Ester
IUPAC Name	ethyl 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-heptadecafluorononanoate
InChI Key	DRLDSHOYANTUND-UHFFFAOYSA-N
Molecular Formula	C11H5F17O2

182

2,3-Dichloropropionic Acid 98.0+%, TCI America™

CAS: 565-64-0 Molecular Formula: C3H4Cl2O2 Molecular Weight (g/mol): 142.963 MDL Number: MFCD00021695 InChI Key: GKFWNPPZHDYVLI-UHFFFAOYSA-N PubChem CID: 11263 IUPAC Name: 2,3-dichloropropanoic acid SMILES: C(C(C(=O)O)Cl)Cl

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Specifications

PubChem CID	11263
CAS	565-64-0
Molecular Weight (g/mol)	142.963
MDL Number	MFCD00021695
SMILES	C(C(C(=O)O)Cl)Cl
IUPAC Name	2,3-dichloropropanoic acid
InChI Key	GKFWNPPZHDYVLI-UHFFFAOYSA-N
Molecular Formula	C3H4Cl2O2

183

2-Chloropropionic Acid 98.0+%, TCI America™

CAS: 598-78-7 Molecular Formula: C3H5ClO2 Molecular Weight (g/mol): 108.52 MDL Number: MFCD00004224 InChI Key: GAWAYYRQGQZKCR-UHFFFAOYNA-N Synonym: 2-chloropropionic acid,propanoic acid, 2-chloro,propionic acid, 2-chloro,alpha-chloropropionic acid,alpha-monochloropropionic acid,propionic acid, alpha-chloro,.alpha.-chloropropionic acid,propionic acid, .alpha.-chloro,chloropropionic acid,propanoic acid, chloro PubChem CID: 11734 IUPAC Name: 2-chloropropanoic acid SMILES: CC(Cl)C(O)=O

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Specifications

PubChem CID	11734
CAS	598-78-7
Molecular Weight (g/mol)	108.52
MDL Number	MFCD00004224
SMILES	CC(Cl)C(O)=O
Synonym	2-chloropropionic acid,propanoic acid, 2-chloro,propionic acid, 2-chloro,alpha-chloropropionic acid,alpha-monochloropropionic acid,propionic acid, alpha-chloro,.alpha.-chloropropionic acid,propionic acid, .alpha.-chloro,chloropropionic acid,propanoic acid, chloro
IUPAC Name	2-chloropropanoic acid
InChI Key	GAWAYYRQGQZKCR-UHFFFAOYNA-N
Molecular Formula	C3H5ClO2

184

Sodium Dichloroacetate 99.0+%, TCI America™

CAS: 2156-56-1 Molecular Formula: C2HCl2NaO2 Molecular Weight (g/mol): 150.92 MDL Number: MFCD00070489 InChI Key: LUPNKHXLFSSUGS-UHFFFAOYSA-M Synonym: sodium dichloroacetate,sodium 2,2-dichloroacetate,dichloroacetic acid sodium salt,acetic acid, dichloro-, sodium salt,ceresine,dichloroacetate sodium,dichloroctan sodny czech,sodium dichloroacetate usan,ccris 7697,dichloroacetic acid, sodium salt PubChem CID: 517326 IUPAC Name: sodium 2,2-dichloroacetate SMILES: [Na+].[O-]C(=O)C(Cl)Cl

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Specifications

PubChem CID	517326
CAS	2156-56-1
Molecular Weight (g/mol)	150.92
MDL Number	MFCD00070489
SMILES	[Na+].[O-]C(=O)C(Cl)Cl
Synonym	sodium dichloroacetate,sodium 2,2-dichloroacetate,dichloroacetic acid sodium salt,acetic acid, dichloro-, sodium salt,ceresine,dichloroacetate sodium,dichloroctan sodny czech,sodium dichloroacetate usan,ccris 7697,dichloroacetic acid, sodium salt
IUPAC Name	sodium 2,2-dichloroacetate
InChI Key	LUPNKHXLFSSUGS-UHFFFAOYSA-M
Molecular Formula	C2HCl2NaO2

185

Butyl Fluoroacetate 97.0+%, TCI America™

CAS: 371-49-3 Molecular Formula: C6H11FO2 Molecular Weight (g/mol): 134.15 MDL Number: MFCD00042194 InChI Key: FZXXGBGMLALCIH-UHFFFAOYSA-N Synonym: Fluoroacetic Acid Butyl Ester PubChem CID: 67790 IUPAC Name: butyl 2-fluoroacetate SMILES: CCCCOC(=O)CF

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Specifications

PubChem CID	67790
CAS	371-49-3
Molecular Weight (g/mol)	134.15
MDL Number	MFCD00042194
SMILES	CCCCOC(=O)CF
Synonym	Fluoroacetic Acid Butyl Ester
IUPAC Name	butyl 2-fluoroacetate
InChI Key	FZXXGBGMLALCIH-UHFFFAOYSA-N
Molecular Formula	C6H11FO2

186

Allyl Trifluoroacetate 95.0+%, TCI America™

CAS: 383-67-5 Molecular Formula: C5H5F3O2 Molecular Weight (g/mol): 154.088 MDL Number: MFCD00013567 InChI Key: XIVPVSIDXBTZLM-UHFFFAOYSA-N Synonym: allyl trifluoroacetate,allyl trifluoracetate,trifluoroacetic acid allyl ester,prop-2-en-1-yl 2,2,2-trifluoroacetate,allyltrifluoroacetate,pubchem12548,acmc-209izu,allyl alcohol, trifluoroacetate,acetic acid, trifluoro-, allyl ester PubChem CID: 67845 IUPAC Name: prop-2-enyl 2,2,2-trifluoroacetate SMILES: C=CCOC(=O)C(F)(F)F

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Specifications

PubChem CID	67845
CAS	383-67-5
Molecular Weight (g/mol)	154.088
MDL Number	MFCD00013567
SMILES	C=CCOC(=O)C(F)(F)F
Synonym	allyl trifluoroacetate,allyl trifluoracetate,trifluoroacetic acid allyl ester,prop-2-en-1-yl 2,2,2-trifluoroacetate,allyltrifluoroacetate,pubchem12548,acmc-209izu,allyl alcohol, trifluoroacetate,acetic acid, trifluoro-, allyl ester
IUPAC Name	prop-2-enyl 2,2,2-trifluoroacetate
InChI Key	XIVPVSIDXBTZLM-UHFFFAOYSA-N
Molecular Formula	C5H5F3O2

187

Allyl Chloroacetate 98.0+%, TCI America™

CAS: 2916-14-5 Molecular Formula: C5H7ClO2 Molecular Weight (g/mol): 134.559 MDL Number: MFCD00058936 InChI Key: VMBJJCDVORDOCF-UHFFFAOYSA-N Synonym: allyl chloroacetate,allyl 2-chloroacetate,chloroacetic acid allyl ester,acetic acid, chloro-, 2-propenyl ester,prop-2-en-1-yl 2-chloroacetate,acetic acid, chloro-, allyl ester,allyl monochloroacetate,acmc-1cffa,chloroacetic acid,2-propenyl ester PubChem CID: 76206 IUPAC Name: prop-2-enyl 2-chloroacetate SMILES: C=CCOC(=O)CCl

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Specifications

PubChem CID	76206
CAS	2916-14-5
Molecular Weight (g/mol)	134.559
MDL Number	MFCD00058936
SMILES	C=CCOC(=O)CCl
Synonym	allyl chloroacetate,allyl 2-chloroacetate,chloroacetic acid allyl ester,acetic acid, chloro-, 2-propenyl ester,prop-2-en-1-yl 2-chloroacetate,acetic acid, chloro-, allyl ester,allyl monochloroacetate,acmc-1cffa,chloroacetic acid,2-propenyl ester
IUPAC Name	prop-2-enyl 2-chloroacetate
InChI Key	VMBJJCDVORDOCF-UHFFFAOYSA-N
Molecular Formula	C5H7ClO2

188

Diethyl Fluoromalonate 95.0+%, TCI America™

CAS: 685-88-1 Molecular Formula: C7H11FO4 Molecular Weight (g/mol): 178.159 MDL Number: MFCD00009139 InChI Key: GOWQBFVDZPZZFA-UHFFFAOYSA-N PubChem CID: 12702 IUPAC Name: diethyl 2-fluoropropanedioate SMILES: CCOC(=O)C(C(=O)OCC)F

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Specifications

PubChem CID	12702
CAS	685-88-1
Molecular Weight (g/mol)	178.159
MDL Number	MFCD00009139
SMILES	CCOC(=O)C(C(=O)OCC)F
IUPAC Name	diethyl 2-fluoropropanedioate
InChI Key	GOWQBFVDZPZZFA-UHFFFAOYSA-N
Molecular Formula	C7H11FO4

189

Dimethyl Tetrafluorosuccinate 95.0+%, TCI America™

CAS: 356-36-5 Molecular Formula: C6H6F4O4 Molecular Weight (g/mol): 218.104 MDL Number: MFCD00043947 InChI Key: RMXAYQBUNVSEPG-UHFFFAOYSA-N Synonym: Dimethyl Perfluorosuccinate, Perfluorosuccinic Acid Dimethyl Ester, Tetrafluorosuccinic Acid Dimethyl Ester, Dimethyl Tetrafluorobutanedioate, Tetrafluorobutanedioic Acid Dimethyl Ester PubChem CID: 2737124 IUPAC Name: dimethyl 2,2,3,3-tetrafluorobutanedioate SMILES: COC(=O)C(C(C(=O)OC)(F)F)(F)F

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Specifications

PubChem CID	2737124
CAS	356-36-5
Molecular Weight (g/mol)	218.104
MDL Number	MFCD00043947
SMILES	COC(=O)C(C(C(=O)OC)(F)F)(F)F
Synonym	Dimethyl Perfluorosuccinate, Perfluorosuccinic Acid Dimethyl Ester, Tetrafluorosuccinic Acid Dimethyl Ester, Dimethyl Tetrafluorobutanedioate, Tetrafluorobutanedioic Acid Dimethyl Ester
IUPAC Name	dimethyl 2,2,3,3-tetrafluorobutanedioate
InChI Key	RMXAYQBUNVSEPG-UHFFFAOYSA-N
Molecular Formula	C6H6F4O4

190

Chlorodifluoroacetic Anhydride 98.0+%, TCI America™

CAS: 2834-23-3 Molecular Formula: C4Cl2F4O3 Molecular Weight (g/mol): 242.93 MDL Number: MFCD00000774 InChI Key: VBJIFLOSOQGDRZ-UHFFFAOYSA-N Synonym: chlorodifluoroacetic anhydride,acetic acid, chlorodifluoro-, anhydride,acetic acid, 2-chloro-2,2-difluoro-, 1,1'-anhydride,chlorodifluoroacetic anhyride,chlorodifluoroacetic acid anhydride,2-chloro-2,2-difluoroacetic anhydride,2-chloro-2,2-difluoroacetyl 2-chloro-2,2-difluoroacetate PubChem CID: 76074 IUPAC Name: 2-chloro-2,2-difluoroacetyl 2-chloro-2,2-difluoroacetate SMILES: FC(F)(Cl)C(=O)OC(=O)C(F)(F)Cl

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Specifications

PubChem CID	76074
CAS	2834-23-3
Molecular Weight (g/mol)	242.93
MDL Number	MFCD00000774
SMILES	FC(F)(Cl)C(=O)OC(=O)C(F)(F)Cl
Synonym	chlorodifluoroacetic anhydride,acetic acid, chlorodifluoro-, anhydride,acetic acid, 2-chloro-2,2-difluoro-, 1,1'-anhydride,chlorodifluoroacetic anhyride,chlorodifluoroacetic acid anhydride,2-chloro-2,2-difluoroacetic anhydride,2-chloro-2,2-difluoroacetyl 2-chloro-2,2-difluoroacetate
IUPAC Name	2-chloro-2,2-difluoroacetyl 2-chloro-2,2-difluoroacetate
InChI Key	VBJIFLOSOQGDRZ-UHFFFAOYSA-N
Molecular Formula	C4Cl2F4O3

191

Sodium Dichloroacetate 97.0+%, TCI America™

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Specifications

PubChem CID	517326
CAS	2156-56-1
Molecular Weight (g/mol)	150.92
MDL Number	MFCD00070489
SMILES	[Na+].[O-]C(=O)C(Cl)Cl
Synonym	sodium dichloroacetate,sodium 2,2-dichloroacetate,dichloroacetic acid sodium salt,acetic acid, dichloro-, sodium salt,ceresine,dichloroacetate sodium,dichloroctan sodny czech,sodium dichloroacetate usan,ccris 7697,dichloroacetic acid, sodium salt
IUPAC Name	sodium 2,2-dichloroacetate
InChI Key	LUPNKHXLFSSUGS-UHFFFAOYSA-M
Molecular Formula	C2HCl2NaO2

192

Ethyl 2,3-Dibromobutyrate 95.0+%, TCI America™

CAS: 609-11-0 Molecular Formula: C6H10Br2O2 Molecular Weight (g/mol): 273.952 MDL Number: MFCD00017863 InChI Key: YPZLAXFGOUPECS-UHFFFAOYSA-N Synonym: 2,3-Dibromobutyric Acid Ethyl Ester PubChem CID: 98157 IUPAC Name: ethyl 2,3-dibromobutanoate SMILES: CCOC(=O)C(C(C)Br)Br

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Specifications

PubChem CID	98157
CAS	609-11-0
Molecular Weight (g/mol)	273.952
MDL Number	MFCD00017863
SMILES	CCOC(=O)C(C(C)Br)Br
Synonym	2,3-Dibromobutyric Acid Ethyl Ester
IUPAC Name	ethyl 2,3-dibromobutanoate
InChI Key	YPZLAXFGOUPECS-UHFFFAOYSA-N
Molecular Formula	C6H10Br2O2

193

Potassium Trifluoroacetate 98.0+%, TCI America™

CAS: 2923-16-2 Molecular Formula: C2F3KO2 Molecular Weight (g/mol): 152.11 MDL Number: MFCD00013215 InChI Key: CUNPJFGIODEJLQ-UHFFFAOYSA-M Synonym: potassium trifluoroacetate,potassium 2,2,2-trifluoroacetate,trifluoroacetic acid potassium salt,acetic acid, trifluoro-, potassium salt,potassiumtrifluoroacetate,pubchem12605,potassium ion trifluoroacetate,ksc492g5t,trifluoroacetic acid, potassium salt,potassium 2,2,2-tris fluoranyl ethanoate PubChem CID: 23662811 IUPAC Name: potassium trifluoroacetate SMILES: [K+].[O-]C(=O)C(F)(F)F

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Specifications

PubChem CID	23662811
CAS	2923-16-2
Molecular Weight (g/mol)	152.11
MDL Number	MFCD00013215
SMILES	[K+].[O-]C(=O)C(F)(F)F
Synonym	potassium trifluoroacetate,potassium 2,2,2-trifluoroacetate,trifluoroacetic acid potassium salt,acetic acid, trifluoro-, potassium salt,potassiumtrifluoroacetate,pubchem12605,potassium ion trifluoroacetate,ksc492g5t,trifluoroacetic acid, potassium salt,potassium 2,2,2-tris fluoranyl ethanoate
IUPAC Name	potassium trifluoroacetate
InChI Key	CUNPJFGIODEJLQ-UHFFFAOYSA-M
Molecular Formula	C2F3KO2

194

Ethyl Fluoroacetate 98.0+%, TCI America™

CAS: 459-72-3 Molecular Formula: C4H7FO2 Molecular Weight (g/mol): 106.096 MDL Number: MFCD00000450 InChI Key: VCYZVXRKYPKDQB-UHFFFAOYSA-N Synonym: ethyl fluoroacetate,ethyl monofluoroacetate,acetic acid, fluoro-, ethyl ester,fluoroacetic acid ethyl ester,unii-aus1l6um7b,ethylester kyseliny fluoroctove,monofluoroacetic acid ethyl ester,aus1l6um7b,ethylester kyseliny fluoroctove czech,acetic acid, 2-fluoro-, ethyl ester PubChem CID: 9988 IUPAC Name: ethyl 2-fluoroacetate SMILES: CCOC(=O)CF

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Specifications

PubChem CID	9988
CAS	459-72-3
Molecular Weight (g/mol)	106.096
MDL Number	MFCD00000450
SMILES	CCOC(=O)CF
Synonym	ethyl fluoroacetate,ethyl monofluoroacetate,acetic acid, fluoro-, ethyl ester,fluoroacetic acid ethyl ester,unii-aus1l6um7b,ethylester kyseliny fluoroctove,monofluoroacetic acid ethyl ester,aus1l6um7b,ethylester kyseliny fluoroctove czech,acetic acid, 2-fluoro-, ethyl ester
IUPAC Name	ethyl 2-fluoroacetate
InChI Key	VCYZVXRKYPKDQB-UHFFFAOYSA-N
Molecular Formula	C4H7FO2

195

Methyl alpha-Bromophenylacetate 98.0+%, TCI America™

CAS: 3042-81-7 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD00013535 InChI Key: NHFBYYMNJUMVOT-UHFFFAOYSA-N Synonym: methyl alpha-bromophenylacetate,methyl bromophenylacetate,methyl bromo phenyl acetate,methyl .alpha.-bromophenylacetate,methyl2-bromo-2-phenylacetate,methyl .alpha.-bromobenzeneacetate,benzeneacetic acid, .alpha.-bromo-, methyl ester,+/--methyl alpha-bromophenylacetate,alpha-bromophenylacetic acid methyl ester,methyl .alpha.-bromo-.alpha.-phenylacetate PubChem CID: 137806 IUPAC Name: methyl 2-bromo-2-phenylacetate SMILES: COC(=O)C(C1=CC=CC=C1)Br

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Specifications

PubChem CID	137806
CAS	3042-81-7
Molecular Weight (g/mol)	229.073
MDL Number	MFCD00013535
SMILES	COC(=O)C(C1=CC=CC=C1)Br
Synonym	methyl alpha-bromophenylacetate,methyl bromophenylacetate,methyl bromo phenyl acetate,methyl .alpha.-bromophenylacetate,methyl2-bromo-2-phenylacetate,methyl .alpha.-bromobenzeneacetate,benzeneacetic acid, .alpha.-bromo-, methyl ester,+/--methyl alpha-bromophenylacetate,alpha-bromophenylacetic acid methyl ester,methyl .alpha.-bromo-.alpha.-phenylacetate
IUPAC Name	methyl 2-bromo-2-phenylacetate
InChI Key	NHFBYYMNJUMVOT-UHFFFAOYSA-N
Molecular Formula	C9H9BrO2

Alpha-halocarboxylic acids and derivatives

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