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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121 – 135 of 572 results

121

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DL-Ethyl 2-bromopropionate, 99%

CAS: 535-11-5 Molecular Formula: C5H9BrO2 Molecular Weight (g/mol): 181.03 MDL Number: MFCD00000144 InChI Key: ARFLASKVLJTEJD-UHFFFAOYNA-N Synonym: ethyl 2-bromopropionate,ethyl alpha-bromopropionate,ethyl-2-bromopropionate,2-bromopropanoic acid ethyl ester,propanoic acid, 2-bromo-, ethyl ester,alpha-bromopropionic acid ethyl ester,ethyl a-bromopropionate,dl-ethyl 2-bromopropionate,2-bromopropionic acid ethyl ester,ethyl alpha-bromopropanoate PubChem CID: 79040 IUPAC Name: ethyl 2-bromopropanoate SMILES: CCOC(=O)C(C)Br

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Specifications

PubChem CID	79040
CAS	535-11-5
Molecular Weight (g/mol)	181.03
MDL Number	MFCD00000144
SMILES	CCOC(=O)C(C)Br
Synonym	ethyl 2-bromopropionate,ethyl alpha-bromopropionate,ethyl-2-bromopropionate,2-bromopropanoic acid ethyl ester,propanoic acid, 2-bromo-, ethyl ester,alpha-bromopropionic acid ethyl ester,ethyl a-bromopropionate,dl-ethyl 2-bromopropionate,2-bromopropionic acid ethyl ester,ethyl alpha-bromopropanoate
IUPAC Name	ethyl 2-bromopropanoate
InChI Key	ARFLASKVLJTEJD-UHFFFAOYNA-N
Molecular Formula	C5H9BrO2

122

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Ethyl fluoroacetate, 97%, Thermo Scientific Chemicals

CAS: 459-72-3 Molecular Formula: C₄H₇FO₂ Molecular Weight (g/mol): 106.1 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)	106.1
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

123

2-Bromopropionic Acid 98.0+%, TCI America™

CAS: 598-72-1 Molecular Formula: C3H5BrO2 Molecular Weight (g/mol): 152.98 MDL Number: MFCD00004211,MFCD00145205 InChI Key: MONMFXREYOKQTI-UHFFFAOYNA-N Synonym: 2-bromopropionic acid,propanoic acid, 2-bromo,dl-2-bromopropionic,propionic acid, 2-bromo,alpha-bromopropionic acid,dl-2-bromopropionic acid,2-bromo-propionic acid,.alpha.-bromopropionic acid,propanoic acid, bromo,propanoicacid, 2-bromo PubChem CID: 11729 IUPAC Name: 2-bromopropanoic acid SMILES: CC(Br)C(O)=O

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Specifications

PubChem CID	11729
CAS	598-72-1
Molecular Weight (g/mol)	152.98
MDL Number	MFCD00004211,MFCD00145205
SMILES	CC(Br)C(O)=O
Synonym	2-bromopropionic acid,propanoic acid, 2-bromo,dl-2-bromopropionic,propionic acid, 2-bromo,alpha-bromopropionic acid,dl-2-bromopropionic acid,2-bromo-propionic acid,.alpha.-bromopropionic acid,propanoic acid, bromo,propanoicacid, 2-bromo
IUPAC Name	2-bromopropanoic acid
InChI Key	MONMFXREYOKQTI-UHFFFAOYNA-N
Molecular Formula	C3H5BrO2

124

Chloroacetic Acid 99.0+%, TCI America™

CAS: 79-11-8 Molecular Formula: C2H3ClO2 Molecular Weight (g/mol): 94.494 MDL Number: MFCD00002683 InChI Key: FOCAUTSVDIKZOP-UHFFFAOYSA-N Synonym: chloroacetic acid,monochloroacetic acid,chloracetic acid,acetic acid, chloro,acide chloracetique,chloroethanoic acid,monochloroethanoic acid,monochloracetic acid,monochloorazijnzuur,monochloressigsaeure PubChem CID: 300 ChEBI: CHEBI:27869 IUPAC Name: 2-chloroacetic acid SMILES: C(C(=O)O)Cl

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Specifications

PubChem CID	300
CAS	79-11-8
Molecular Weight (g/mol)	94.494
ChEBI	CHEBI:27869
MDL Number	MFCD00002683
SMILES	C(C(=O)O)Cl
Synonym	chloroacetic acid,monochloroacetic acid,chloracetic acid,acetic acid, chloro,acide chloracetique,chloroethanoic acid,monochloroethanoic acid,monochloracetic acid,monochloorazijnzuur,monochloressigsaeure
IUPAC Name	2-chloroacetic acid
InChI Key	FOCAUTSVDIKZOP-UHFFFAOYSA-N
Molecular Formula	C2H3ClO2

125

Sodium Chlorodifluoroacetate 99.0+%, TCI America™

CAS: 1895-39-2 Molecular Formula: C2ClF2NaO2 Molecular Weight (g/mol): 152.457 MDL Number: MFCD00064771 InChI Key: MRTAVLDNYYEJHK-UHFFFAOYSA-M Synonym: sodium chlorodifluoroacetate,sodium 2-chloro-2,2-difluoroacetate,chlorodifluoroacetic acid sodium salt,sodium chloro difluoro acetate,acetic acid, chlorodifluoro-, sodium salt,sodiumchlorodifluoroacetate,difluorochloroacetic acid sodium salt,sodium difluorochloroacetate,chlorodifluoroacetic acid sodium PubChem CID: 2734985 IUPAC Name: sodium;2-chloro-2,2-difluoroacetate SMILES: C(=O)(C(F)(F)Cl)[O-].[Na+]

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Specifications

PubChem CID	2734985
CAS	1895-39-2
Molecular Weight (g/mol)	152.457
MDL Number	MFCD00064771
SMILES	C(=O)(C(F)(F)Cl)[O-].[Na+]
Synonym	sodium chlorodifluoroacetate,sodium 2-chloro-2,2-difluoroacetate,chlorodifluoroacetic acid sodium salt,sodium chloro difluoro acetate,acetic acid, chlorodifluoro-, sodium salt,sodiumchlorodifluoroacetate,difluorochloroacetic acid sodium salt,sodium difluorochloroacetate,chlorodifluoroacetic acid sodium
IUPAC Name	sodium;2-chloro-2,2-difluoroacetate
InChI Key	MRTAVLDNYYEJHK-UHFFFAOYSA-M
Molecular Formula	C2ClF2NaO2

126

Butyl Chloroacetate 98.0+%, TCI America™

CAS: 590-02-3 Molecular Formula: C6H11ClO2 Molecular Weight (g/mol): 150.60 MDL Number: MFCD00018925 InChI Key: YJRGMUWRPCPLNH-UHFFFAOYSA-N Synonym: Chloroacetic Acid Butyl Ester PubChem CID: 11530 IUPAC Name: butyl 2-chloroacetate SMILES: CCCCOC(=O)CCl

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Specifications

PubChem CID	11530
CAS	590-02-3
Molecular Weight (g/mol)	150.60
MDL Number	MFCD00018925
SMILES	CCCCOC(=O)CCl
Synonym	Chloroacetic Acid Butyl Ester
IUPAC Name	butyl 2-chloroacetate
InChI Key	YJRGMUWRPCPLNH-UHFFFAOYSA-N
Molecular Formula	C6H11ClO2

127

Benzyl Chloroacetate 97.0+%, TCI America™

CAS: 140-18-1 Molecular Formula: C9H9ClO2 Molecular Weight (g/mol): 184.619 MDL Number: MFCD00157062 InChI Key: SOGXBRHOWDEKQB-UHFFFAOYSA-N Synonym: benzyl chloroacetate,benzyl monochloracetate,acetic acid, chloro-, phenylmethyl ester,chloroacetic acid, benzyl ester,monochloroacetate,chloroacetic acid benzyl ester,benzyl-alpha-chloroacetate,phenylmethyl chloroacetate,acetic acid, chloro-, benzyl ester,phenylmethyl 2-chloroacetate PubChem CID: 8786 IUPAC Name: benzyl 2-chloroacetate SMILES: C1=CC=C(C=C1)COC(=O)CCl

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Specifications

PubChem CID	8786
CAS	140-18-1
Molecular Weight (g/mol)	184.619
MDL Number	MFCD00157062
SMILES	C1=CC=C(C=C1)COC(=O)CCl
Synonym	benzyl chloroacetate,benzyl monochloracetate,acetic acid, chloro-, phenylmethyl ester,chloroacetic acid, benzyl ester,monochloroacetate,chloroacetic acid benzyl ester,benzyl-alpha-chloroacetate,phenylmethyl chloroacetate,acetic acid, chloro-, benzyl ester,phenylmethyl 2-chloroacetate
IUPAC Name	benzyl 2-chloroacetate
InChI Key	SOGXBRHOWDEKQB-UHFFFAOYSA-N
Molecular Formula	C9H9ClO2

128

Ethyl Chlorodifluoroacetate 97.0+%, TCI America™

CAS: 383-62-0 Molecular Formula: C4H5ClF2O2 Molecular Weight (g/mol): 158.529 MDL Number: MFCD00013662 InChI Key: GVCAWQUJCHZRCB-UHFFFAOYSA-N Synonym: ethyl chlorodifluoroacetate,chlorodifluoroacetic acid ethyl ester,ethyl chlorodifluoroethanoate,acetic acid, chlorodifluoro-, ethyl ester,ethylchlorodifluoroacetate,acetic acid, 2-chloro-2,2-difluoro-, ethyl ester,ethyl 2-chloro-2,2-difluoro-acetate,pubchem12573,ethyl chlordifluoroacetate,acmc-1cr8n PubChem CID: 67843 IUPAC Name: ethyl 2-chloro-2,2-difluoroacetate SMILES: CCOC(=O)C(F)(F)Cl

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Specifications

PubChem CID	67843
CAS	383-62-0
Molecular Weight (g/mol)	158.529
MDL Number	MFCD00013662
SMILES	CCOC(=O)C(F)(F)Cl
Synonym	ethyl chlorodifluoroacetate,chlorodifluoroacetic acid ethyl ester,ethyl chlorodifluoroethanoate,acetic acid, chlorodifluoro-, ethyl ester,ethylchlorodifluoroacetate,acetic acid, 2-chloro-2,2-difluoro-, ethyl ester,ethyl 2-chloro-2,2-difluoro-acetate,pubchem12573,ethyl chlordifluoroacetate,acmc-1cr8n
IUPAC Name	ethyl 2-chloro-2,2-difluoroacetate
InChI Key	GVCAWQUJCHZRCB-UHFFFAOYSA-N
Molecular Formula	C4H5ClF2O2

129

Ethyl 2-Fluoroacetoacetate 95.0+%, TCI America™

CAS: 1522-41-4 Molecular Formula: C6H9FO3 Molecular Weight (g/mol): 148.133 MDL Number: MFCD00215830 InChI Key: SHTFQLHOTAJQRJ-UHFFFAOYSA-N Synonym: ethyl 2-fluoroacetoacetate,ethyl2-fluoroacetoacetate,2-fluoro-3-oxo-butanoic acid ethyl ester,2-fluoroacetoacetic acid ethyl ester,ethyl 2-fluoro-3-oxobutyrate,2-fluoro-3-oxo-butyric acid ethyl ester,ethyl 2-fluoro-3-oxo-butanoate,ethyl-2-fluoroacetoacetate,ethyl-2-fluoro-3-oxobutanoate,fluoroacetoacetic acid ethyl ester PubChem CID: 230078 IUPAC Name: ethyl 2-fluoro-3-oxobutanoate SMILES: CCOC(=O)C(C(=O)C)F

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Specifications

PubChem CID	230078
CAS	1522-41-4
Molecular Weight (g/mol)	148.133
MDL Number	MFCD00215830
SMILES	CCOC(=O)C(C(=O)C)F
Synonym	ethyl 2-fluoroacetoacetate,ethyl2-fluoroacetoacetate,2-fluoro-3-oxo-butanoic acid ethyl ester,2-fluoroacetoacetic acid ethyl ester,ethyl 2-fluoro-3-oxobutyrate,2-fluoro-3-oxo-butyric acid ethyl ester,ethyl 2-fluoro-3-oxo-butanoate,ethyl-2-fluoroacetoacetate,ethyl-2-fluoro-3-oxobutanoate,fluoroacetoacetic acid ethyl ester
IUPAC Name	ethyl 2-fluoro-3-oxobutanoate
InChI Key	SHTFQLHOTAJQRJ-UHFFFAOYSA-N
Molecular Formula	C6H9FO3

130

Ethyl Bromodifluoroacetate 98.0+%, TCI America™

CAS: 667-27-6 Molecular Formula: C4H5BrF2O2 Molecular Weight (g/mol): 202.983 MDL Number: MFCD00042069 InChI Key: IRSJDVYTJUCXRV-UHFFFAOYSA-N Synonym: ethyl bromodifluoroacetate,ethylbromodifluoroacetate,bromodifluoroacetic acid ethyl ester,acetic acid, bromodifluoro-, ethyl ester,ethyl difluorobromoacetate,ethyl 2-bromo-2,2-difluoro-acetate,2-bromo-2,2-difluoro-1-ethoxyethan-1-one,2-bromo-2,2-difluoro-1-ethoxy-1-oxoethane,ethylbrom difluor acetat,pubchem16953 PubChem CID: 69585 IUPAC Name: ethyl 2-bromo-2,2-difluoroacetate SMILES: CCOC(=O)C(F)(F)Br

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Specifications

PubChem CID	69585
CAS	667-27-6
Molecular Weight (g/mol)	202.983
MDL Number	MFCD00042069
SMILES	CCOC(=O)C(F)(F)Br
Synonym	ethyl bromodifluoroacetate,ethylbromodifluoroacetate,bromodifluoroacetic acid ethyl ester,acetic acid, bromodifluoro-, ethyl ester,ethyl difluorobromoacetate,ethyl 2-bromo-2,2-difluoro-acetate,2-bromo-2,2-difluoro-1-ethoxyethan-1-one,2-bromo-2,2-difluoro-1-ethoxy-1-oxoethane,ethylbrom difluor acetat,pubchem16953
IUPAC Name	ethyl 2-bromo-2,2-difluoroacetate
InChI Key	IRSJDVYTJUCXRV-UHFFFAOYSA-N
Molecular Formula	C4H5BrF2O2

131

Difluoroacetic Anhydride 98.0+%, TCI America™

CAS: 401-67-2 Molecular Formula: C4H2F4O3 Molecular Weight (g/mol): 174.051 MDL Number: MFCD02093315 InChI Key: IYXUFOCLMOXQSL-UHFFFAOYSA-N PubChem CID: 2774048 IUPAC Name: (2,2-difluoroacetyl) 2,2-difluoroacetate SMILES: C(C(=O)OC(=O)C(F)F)(F)F

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Specifications

PubChem CID	2774048
CAS	401-67-2
Molecular Weight (g/mol)	174.051
MDL Number	MFCD02093315
SMILES	C(C(=O)OC(=O)C(F)F)(F)F
IUPAC Name	(2,2-difluoroacetyl) 2,2-difluoroacetate
InChI Key	IYXUFOCLMOXQSL-UHFFFAOYSA-N
Molecular Formula	C4H2F4O3

132

Chlorodifluoroacetic Acid 98.0+%, TCI America™

CAS: 76-04-0 Molecular Formula: C2HClF2O2 Molecular Weight (g/mol): 130.475 MDL Number: MFCD00004176 InChI Key: OAWAZQITIZDJRB-UHFFFAOYSA-N Synonym: chlorodifluoroacetic acid,acetic acid, chlorodifluoro,difluorochloroacetic acid,chloro difluoro acetic acid,2-chloro-2,2-difluoro-acetic acid,acetic acid, 2-chloro-2,2-difluoro,snpljqdjptadtaetp@,chlorodifluoroaceticacid,chlorodifluoro acetic acid,acmc-209p1k PubChem CID: 66154 IUPAC Name: 2-chloro-2,2-difluoroacetic acid SMILES: C(=O)(C(F)(F)Cl)O

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Specifications

PubChem CID	66154
CAS	76-04-0
Molecular Weight (g/mol)	130.475
MDL Number	MFCD00004176
SMILES	C(=O)(C(F)(F)Cl)O
Synonym	chlorodifluoroacetic acid,acetic acid, chlorodifluoro,difluorochloroacetic acid,chloro difluoro acetic acid,2-chloro-2,2-difluoro-acetic acid,acetic acid, 2-chloro-2,2-difluoro,snpljqdjptadtaetp@,chlorodifluoroaceticacid,chlorodifluoro acetic acid,acmc-209p1k
IUPAC Name	2-chloro-2,2-difluoroacetic acid
InChI Key	OAWAZQITIZDJRB-UHFFFAOYSA-N
Molecular Formula	C2HClF2O2

133

tert-Butyl Bromoacetate 98.0+%, TCI America™

CAS: 5292-43-3 Molecular Formula: C6H11BrO2 Molecular Weight (g/mol): 195.06 MDL Number: MFCD00000188 InChI Key: BNWCETAHAJSBFG-UHFFFAOYSA-N Synonym: tert-butyl bromoacetate,t-butyl bromoacetate,acetic acid, bromo-, 1,1-dimethylethyl ester,bromoacetic acid tert-butyl ester,tert-butylbromoacetate,acetic acid, bromo-, tert-butyl ester,brch2c o oc ch3 3,acetic acid, 2-bromo-, 1,1-dimethylethyl ester,bromo-acetic acid tert-butyl ester,tert-butylbromacetat PubChem CID: 79177 IUPAC Name: tert-butyl 2-bromoacetate SMILES: CC(C)(C)OC(=O)CBr

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Specifications

PubChem CID	79177
CAS	5292-43-3
Molecular Weight (g/mol)	195.06
MDL Number	MFCD00000188
SMILES	CC(C)(C)OC(=O)CBr
Synonym	tert-butyl bromoacetate,t-butyl bromoacetate,acetic acid, bromo-, 1,1-dimethylethyl ester,bromoacetic acid tert-butyl ester,tert-butylbromoacetate,acetic acid, bromo-, tert-butyl ester,brch2c o oc ch3 3,acetic acid, 2-bromo-, 1,1-dimethylethyl ester,bromo-acetic acid tert-butyl ester,tert-butylbromacetat
IUPAC Name	tert-butyl 2-bromoacetate
InChI Key	BNWCETAHAJSBFG-UHFFFAOYSA-N
Molecular Formula	C6H11BrO2

134

3-Chloro-2,2,3,3-tetrafluoropropionic Acid 98.0+%, TCI America™

CAS: 661-82-5 Molecular Formula: C3HClF4O2 Molecular Weight (g/mol): 180.483 MDL Number: MFCD00153099 InChI Key: XJRMCFMZGRJXEZ-UHFFFAOYSA-N PubChem CID: 2782491 IUPAC Name: 3-chloro-2,2,3,3-tetrafluoropropanoic acid SMILES: C(=O)(C(C(F)(F)Cl)(F)F)O

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Specifications

PubChem CID	2782491
CAS	661-82-5
Molecular Weight (g/mol)	180.483
MDL Number	MFCD00153099
SMILES	C(=O)(C(C(F)(F)Cl)(F)F)O
IUPAC Name	3-chloro-2,2,3,3-tetrafluoropropanoic acid
InChI Key	XJRMCFMZGRJXEZ-UHFFFAOYSA-N
Molecular Formula	C3HClF4O2

135

Ethyl Trichloroacetate 97.0+%, TCI America™

CAS: 515-84-4 Molecular Formula: C4H5Cl3O2 Molecular Weight (g/mol): 191.43 MDL Number: MFCD00000795 InChI Key: SJMLNDPIJZBEKY-UHFFFAOYSA-N Synonym: ethyl trichloroacetate,acetic acid, trichloro-, ethyl ester,unii-br8fkn5z55,acetic acid, ester with trichloroethanol,ethyltrichloroacetate,br8fkn5z55,acetic acid, 2,2,2-trichloro-, ethyl ester,acmc-209kup,ethyl-2,2,2-trichloroacetate PubChem CID: 10588 IUPAC Name: ethyl 2,2,2-trichloroacetate SMILES: CCOC(=O)C(Cl)(Cl)Cl

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Specifications

PubChem CID	10588
CAS	515-84-4
Molecular Weight (g/mol)	191.43
MDL Number	MFCD00000795
SMILES	CCOC(=O)C(Cl)(Cl)Cl
Synonym	ethyl trichloroacetate,acetic acid, trichloro-, ethyl ester,unii-br8fkn5z55,acetic acid, ester with trichloroethanol,ethyltrichloroacetate,br8fkn5z55,acetic acid, 2,2,2-trichloro-, ethyl ester,acmc-209kup,ethyl-2,2,2-trichloroacetate
IUPAC Name	ethyl 2,2,2-trichloroacetate
InChI Key	SJMLNDPIJZBEKY-UHFFFAOYSA-N
Molecular Formula	C4H5Cl3O2

Alpha-halocarboxylic acids and derivatives

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