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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136 – 150 of 567 results

136

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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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

137

Dimethyl Chloromalonate 98.0+%, TCI America™

CAS: 28868-76-0 Molecular Formula: C5H7ClO4 Molecular Weight (g/mol): 166.56 MDL Number: MFCD00042837 InChI Key: LNBQBURECUEBKZ-UHFFFAOYSA-N Synonym: Chloromalonic Acid Dimethyl Ester PubChem CID: 120070 IUPAC Name: 1,3-dimethyl 2-chloropropanedioate SMILES: COC(=O)C(Cl)C(=O)OC

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Specifications

PubChem CID	120070
CAS	28868-76-0
Molecular Weight (g/mol)	166.56
MDL Number	MFCD00042837
SMILES	COC(=O)C(Cl)C(=O)OC
Synonym	Chloromalonic Acid Dimethyl Ester
IUPAC Name	1,3-dimethyl 2-chloropropanedioate
InChI Key	LNBQBURECUEBKZ-UHFFFAOYSA-N
Molecular Formula	C5H7ClO4

138

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

139

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

140

Ethyl 2-Bromopropionate 98.0+%, TCI America™

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

141

Sodium Trifluoroacetate 98.0+%, TCI America™

CAS: 2923-18-4 Molecular Formula: C2F3NaO2 Molecular Weight (g/mol): 136.01 MDL Number: MFCD00013217 InChI Key: UYCAUPASBSROMS-UHFFFAOYSA-M Synonym: sodium trifluoroacetate,trifluoroacetic acid sodium salt,acetic acid, trifluoro-, sodium salt,sodium perfluoroacetate,trifluoroacetate sodium,sodium 2,2,2-trifluoroacetate,trifluoroacetic acid sodium,trifluoroacetic acid,sodium salt,acetic acid, 2,2,2-trifluoro-, sodium salt 1:1,trifluoroacetic acid, sodium salt PubChem CID: 517019 IUPAC Name: sodium trifluoroacetate SMILES: [Na+].[O-]C(=O)C(F)(F)F

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Specifications

PubChem CID	517019
CAS	2923-18-4
Molecular Weight (g/mol)	136.01
MDL Number	MFCD00013217
SMILES	[Na+].[O-]C(=O)C(F)(F)F
Synonym	sodium trifluoroacetate,trifluoroacetic acid sodium salt,acetic acid, trifluoro-, sodium salt,sodium perfluoroacetate,trifluoroacetate sodium,sodium 2,2,2-trifluoroacetate,trifluoroacetic acid sodium,trifluoroacetic acid,sodium salt,acetic acid, 2,2,2-trifluoro-, sodium salt 1:1,trifluoroacetic acid, sodium salt
IUPAC Name	sodium trifluoroacetate
InChI Key	UYCAUPASBSROMS-UHFFFAOYSA-M
Molecular Formula	C2F3NaO2

142

(S)-(-)-2-Chloropropionic Acid 98.0+%, TCI America™

CAS: 29617-66-1 Molecular Formula: C3H4ClO2 Molecular Weight (g/mol): 107.51 MDL Number: MFCD00064205 InChI Key: GAWAYYRQGQZKCR-REOHCLBHSA-M Synonym: s---2-chloropropionic acid,s-2-chloropropanoic acid,s-2-chloropropionic acid,2s-2-chloropropanoic acid,l-2-chloropropanoic acid,l-2-chloropropionic acid,alpha-l-chloropropionic acid,unii-pcc7j322cm,2s-chloropropanoic acid,2 s-chloropropionic acid PubChem CID: 107915 ChEBI: CHEBI:73956 IUPAC Name: (2S)-2-chloropropanoate SMILES: C[C@H](Cl)C([O-])=O

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Specifications

PubChem CID	107915
CAS	29617-66-1
Molecular Weight (g/mol)	107.51
ChEBI	CHEBI:73956
MDL Number	MFCD00064205
SMILES	C[C@H](Cl)C([O-])=O
Synonym	s---2-chloropropionic acid,s-2-chloropropanoic acid,s-2-chloropropionic acid,2s-2-chloropropanoic acid,l-2-chloropropanoic acid,l-2-chloropropionic acid,alpha-l-chloropropionic acid,unii-pcc7j322cm,2s-chloropropanoic acid,2 s-chloropropionic acid
IUPAC Name	(2S)-2-chloropropanoate
InChI Key	GAWAYYRQGQZKCR-REOHCLBHSA-M
Molecular Formula	C3H4ClO2

143

tert-Butyl 2-Bromopropionate 97.0+%, TCI America™

CAS: 39149-80-9 Molecular Formula: C7H13BrO2 Molecular Weight (g/mol): 209.083 MDL Number: MFCD00043897 InChI Key: CVAWKJKISIPBOD-UHFFFAOYSA-N Synonym: 2-Bromopropionic Acid tert-Butyl Ester PubChem CID: 545327 IUPAC Name: tert-butyl 2-bromopropanoate SMILES: CC(C(=O)OC(C)(C)C)Br

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Specifications

PubChem CID	545327
CAS	39149-80-9
Molecular Weight (g/mol)	209.083
MDL Number	MFCD00043897
SMILES	CC(C(=O)OC(C)(C)C)Br
Synonym	2-Bromopropionic Acid tert-Butyl Ester
IUPAC Name	tert-butyl 2-bromopropanoate
InChI Key	CVAWKJKISIPBOD-UHFFFAOYSA-N
Molecular Formula	C7H13BrO2

144

Ethyl 2-Bromoisovalerate 98.0+%, TCI America™

CAS: 609-12-1 Molecular Formula: C7H13BrO2 Molecular Weight (g/mol): 209.083 MDL Number: MFCD00026855 InChI Key: WNFUWONOILPKNX-UHFFFAOYSA-N Synonym: ethyl 2-bromoisovalerate,ethyl 2-bromo-3-methylbutyrate,butanoic acid, 2-bromo-3-methyl-, ethyl ester,ethyl .alpha.-bromoisovalerate,2-bromoisovaleric acid ethyl ester,butyric acid, 2-bromo-3-methyl-, ethyl ester,ethyl 2-bromo-3-methyl-butanoate,.alpha.-bromoisovaleric acid ethyl ester,ethyl,a-bromoisovalerate,ethyl 2-bromo isovalerate PubChem CID: 79068 IUPAC Name: ethyl 2-bromo-3-methylbutanoate SMILES: CCOC(=O)C(C(C)C)Br

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PubChem CID	79068
CAS	609-12-1
Molecular Weight (g/mol)	209.083
MDL Number	MFCD00026855
SMILES	CCOC(=O)C(C(C)C)Br
Synonym	ethyl 2-bromoisovalerate,ethyl 2-bromo-3-methylbutyrate,butanoic acid, 2-bromo-3-methyl-, ethyl ester,ethyl .alpha.-bromoisovalerate,2-bromoisovaleric acid ethyl ester,butyric acid, 2-bromo-3-methyl-, ethyl ester,ethyl 2-bromo-3-methyl-butanoate,.alpha.-bromoisovaleric acid ethyl ester,ethyl,a-bromoisovalerate,ethyl 2-bromo isovalerate
IUPAC Name	ethyl 2-bromo-3-methylbutanoate
InChI Key	WNFUWONOILPKNX-UHFFFAOYSA-N
Molecular Formula	C7H13BrO2

145

Methyl 2-Bromohexanoate 98.0+%, TCI America™

CAS: 5445-19-2 Molecular Formula: C7H13BrO2 Molecular Weight (g/mol): 209.083 MDL Number: MFCD00045038 InChI Key: YGLPDRIMFIXNBI-UHFFFAOYSA-N Synonym: 2-bromohexanoic acid methyl ester,hexanoic acid, 2-bromo-, methyl ester,methyl 2-bromocaproate,methyl 2-bromanylhexanoate,methyl bromohexanoate,hexanoic acid, 2-bromo-, methyl ester, s,methyl-2-bromohexanoate,acmc-20mk9n,ksc490a4j,methyl-2-bromocaproate PubChem CID: 95578 IUPAC Name: methyl 2-bromohexanoate SMILES: CCCCC(C(=O)OC)Br

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Specifications

PubChem CID	95578
CAS	5445-19-2
Molecular Weight (g/mol)	209.083
MDL Number	MFCD00045038
SMILES	CCCCC(C(=O)OC)Br
Synonym	2-bromohexanoic acid methyl ester,hexanoic acid, 2-bromo-, methyl ester,methyl 2-bromocaproate,methyl 2-bromanylhexanoate,methyl bromohexanoate,hexanoic acid, 2-bromo-, methyl ester, s,methyl-2-bromohexanoate,acmc-20mk9n,ksc490a4j,methyl-2-bromocaproate
IUPAC Name	methyl 2-bromohexanoate
InChI Key	YGLPDRIMFIXNBI-UHFFFAOYSA-N
Molecular Formula	C7H13BrO2

146

(R)-(+)-2-Chloropropionic Acid 98.0+%, TCI America™

CAS: 7474-05-7 Molecular Formula: C3H4ClO2 Molecular Weight (g/mol): 107.51 MDL Number: MFCD00064204 InChI Key: GAWAYYRQGQZKCR-UWTATZPHSA-M Synonym: r-+-2-chloropropionic acid,r-2-chloropropanoic acid,r-2-chloropropionic acid,r-2-chloro-propionic acid,r +-2-chloropropionic acid,unii-f60st8319r,2-chloropropionic acid, +,propanoic acid, 2-chloro-, 2r,d-2-chloropropionic acid,+-2-chloropropanoic acid PubChem CID: 2724540 IUPAC Name: (2R)-2-chloropropanoic acid SMILES: CC(C(=O)O)Cl

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Specifications

PubChem CID	2724540
CAS	7474-05-7
Molecular Weight (g/mol)	107.51
MDL Number	MFCD00064204
SMILES	CC(C(=O)O)Cl
Synonym	r-+-2-chloropropionic acid,r-2-chloropropanoic acid,r-2-chloropropionic acid,r-2-chloro-propionic acid,r +-2-chloropropionic acid,unii-f60st8319r,2-chloropropionic acid, +,propanoic acid, 2-chloro-, 2r,d-2-chloropropionic acid,+-2-chloropropanoic acid
IUPAC Name	(2R)-2-chloropropanoic acid
InChI Key	GAWAYYRQGQZKCR-UWTATZPHSA-M
Molecular Formula	C3H4ClO2

147

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

148

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

149

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

150

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

Alpha-halocarboxylic acids and derivatives

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