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 577 results

121

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Ethyl chloroacetate, 99%

CAS: 105-39-5 MDL Number: MFCD00000932 InChI Key: VEUUMBGHMNQHGO-UHFFFAOYSA-N Synonym: ethyl chloroacetate,ethyl chloracetate,ethyl monochloroacetate,acetic acid, chloro-, ethyl ester,chloroacetic acid ethyl ester,ethyl monochloracetate,ethyl chloroethanoate,ethyl alpha-chloroacetate,2-chloroacetic acid ethyl ester,unii-6h07teh4tf PubChem CID: 7751 IUPAC Name: ethyl 2-chloroacetate SMILES: CCOC(=O)CCl

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PubChem CID	7751
CAS	105-39-5
MDL Number	MFCD00000932
SMILES	CCOC(=O)CCl
Synonym	ethyl chloroacetate,ethyl chloracetate,ethyl monochloroacetate,acetic acid, chloro-, ethyl ester,chloroacetic acid ethyl ester,ethyl monochloracetate,ethyl chloroethanoate,ethyl alpha-chloroacetate,2-chloroacetic acid ethyl ester,unii-6h07teh4tf
IUPAC Name	ethyl 2-chloroacetate
InChI Key	VEUUMBGHMNQHGO-UHFFFAOYSA-N

122

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3H-Tetrafluoropropionic acid, 97%

CAS: 756-09-2 Molecular Formula: C3H2F4O2 Molecular Weight (g/mol): 146.041 MDL Number: MFCD00054686 InChI Key: PXRROZVNOOEPPZ-UHFFFAOYSA-N Synonym: flupropanate,3h-tetrafluoropropionic acid,2,2,3,3-tetrafluoropropionic acid,unii-376ks3j2q6,propanoic acid, 2,2,3,3-tetrafluoro,flupropanate iso,tetrafluoropropionic acid,pxrrozvnooeppz-uhfffaoysa PubChem CID: 69789 ChEBI: CHEBI:82013 IUPAC Name: 2,2,3,3-tetrafluoropropanoic acid SMILES: C(C(C(=O)O)(F)F)(F)F

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Specifications

PubChem CID	69789
CAS	756-09-2
Molecular Weight (g/mol)	146.041
ChEBI	CHEBI:82013
MDL Number	MFCD00054686
SMILES	C(C(C(=O)O)(F)F)(F)F
Synonym	flupropanate,3h-tetrafluoropropionic acid,2,2,3,3-tetrafluoropropionic acid,unii-376ks3j2q6,propanoic acid, 2,2,3,3-tetrafluoro,flupropanate iso,tetrafluoropropionic acid,pxrrozvnooeppz-uhfffaoysa
IUPAC Name	2,2,3,3-tetrafluoropropanoic acid
InChI Key	PXRROZVNOOEPPZ-UHFFFAOYSA-N
Molecular Formula	C3H2F4O2

123

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

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

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

127

Diisopropylamine Dichloroacetate 98.0+%, TCI America™

CAS: 660-27-5 Molecular Formula: C8H17Cl2NO2 Molecular Weight (g/mol): 230.13 MDL Number: MFCD00868288 InChI Key: ILKBHIBYKSHTKQ-UHFFFAOYSA-N Synonym: diisopropylamine dichloroacetate,diisopropylammonium dichloroacetate,diisopropylamine 2,2-dichloroacetate,vasculopatina,dipromonium,cubisol,dapocel,disotat,kalodil,oxypangam PubChem CID: 12617 IUPAC Name: 2,2-dichloroacetic acid; bis(propan-2-yl)amine SMILES: OC(=O)C(Cl)Cl.CC(C)NC(C)C

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Specifications

PubChem CID	12617
CAS	660-27-5
Molecular Weight (g/mol)	230.13
MDL Number	MFCD00868288
SMILES	OC(=O)C(Cl)Cl.CC(C)NC(C)C
Synonym	diisopropylamine dichloroacetate,diisopropylammonium dichloroacetate,diisopropylamine 2,2-dichloroacetate,vasculopatina,dipromonium,cubisol,dapocel,disotat,kalodil,oxypangam
IUPAC Name	2,2-dichloroacetic acid; bis(propan-2-yl)amine
InChI Key	ILKBHIBYKSHTKQ-UHFFFAOYSA-N
Molecular Formula	C8H17Cl2NO2

128

1,2-Bis(chloroacetoxy)ethane 98.0+%, TCI America™

CAS: 6941-69-1 Molecular Formula: C6H8Cl2O4 Molecular Weight (g/mol): 215.026 MDL Number: MFCD00045277 InChI Key: HIIBHBNRMVLLKH-UHFFFAOYSA-N Synonym: Ethylene Glycol Bis(monochloroacetate), Ethylene Glycol Dichloroacetate PubChem CID: 81365 IUPAC Name: 2-(2-chloroacetyl)oxyethyl 2-chloroacetate SMILES: C(COC(=O)CCl)OC(=O)CCl

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Specifications

PubChem CID	81365
CAS	6941-69-1
Molecular Weight (g/mol)	215.026
MDL Number	MFCD00045277
SMILES	C(COC(=O)CCl)OC(=O)CCl
Synonym	Ethylene Glycol Bis(monochloroacetate), Ethylene Glycol Dichloroacetate
IUPAC Name	2-(2-chloroacetyl)oxyethyl 2-chloroacetate
InChI Key	HIIBHBNRMVLLKH-UHFFFAOYSA-N
Molecular Formula	C6H8Cl2O4

129

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

130

Dimethyl Octafluoroadipate 97.0+%, TCI America™

CAS: 3107-98-0 Molecular Formula: C8H6F8O4 Molecular Weight (g/mol): 318.119 MDL Number: MFCD00042267 InChI Key: XPXVIIILXUOEQA-UHFFFAOYSA-N Synonym: dimethyl octafluoroadipate,dimethyl perfluoroadipate,hexanedioic acid, octafluoro-, dimethyl ester,1,6-dimethyl 2,2,3,3,4,4,5,5-octafluorohexanedioate,dimethyloctafluoroadipate,acmc-1cson,dimethyl octafluoroadipinate,dimethyl octafluorohexanedioate,perfluoroadipic acid dimethyl ester,octafluoroadipic acid dimethyl ester PubChem CID: 2737117 IUPAC Name: dimethyl 2,2,3,3,4,4,5,5-octafluorohexanedioate SMILES: COC(=O)C(C(C(C(C(=O)OC)(F)F)(F)F)(F)F)(F)F

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Specifications

PubChem CID	2737117
CAS	3107-98-0
Molecular Weight (g/mol)	318.119
MDL Number	MFCD00042267
SMILES	COC(=O)C(C(C(C(C(=O)OC)(F)F)(F)F)(F)F)(F)F
Synonym	dimethyl octafluoroadipate,dimethyl perfluoroadipate,hexanedioic acid, octafluoro-, dimethyl ester,1,6-dimethyl 2,2,3,3,4,4,5,5-octafluorohexanedioate,dimethyloctafluoroadipate,acmc-1cson,dimethyl octafluoroadipinate,dimethyl octafluorohexanedioate,perfluoroadipic acid dimethyl ester,octafluoroadipic acid dimethyl ester
IUPAC Name	dimethyl 2,2,3,3,4,4,5,5-octafluorohexanedioate
InChI Key	XPXVIIILXUOEQA-UHFFFAOYSA-N
Molecular Formula	C8H6F8O4

131

Palladium(II) Trifluoroacetate 98.0+%, TCI America™

CAS: 42196-31-6 Molecular Formula: C4F6O4Pd Molecular Weight (g/mol): 332.45 MDL Number: MFCD00013204 InChI Key: PBDBXAQKXCXZCJ-UHFFFAOYSA-L Synonym: palladium ii trifluoroacetate,palladium ii 2,2,2-trifluoroacetate,palladium 2+ ion ditrifluoroacetate,palladium trifluoroacetate,palladium 2+ ditrifluoroacetate,trifluoroacetic acid palladium ii salt,bis 2,2,2-trifluoroacetoxy palladium,acmc-209jo7,ksc235m3d PubChem CID: 2733347 IUPAC Name: palladium(2+) ditrifluoroacetate SMILES: [Pd++].[O-]C(=O)C(F)(F)F.[O-]C(=O)C(F)(F)F

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Specifications

PubChem CID	2733347
CAS	42196-31-6
Molecular Weight (g/mol)	332.45
MDL Number	MFCD00013204
SMILES	[Pd++].[O-]C(=O)C(F)(F)F.[O-]C(=O)C(F)(F)F
Synonym	palladium ii trifluoroacetate,palladium ii 2,2,2-trifluoroacetate,palladium 2+ ion ditrifluoroacetate,palladium trifluoroacetate,palladium 2+ ditrifluoroacetate,trifluoroacetic acid palladium ii salt,bis 2,2,2-trifluoroacetoxy palladium,acmc-209jo7,ksc235m3d
IUPAC Name	palladium(2+) ditrifluoroacetate
InChI Key	PBDBXAQKXCXZCJ-UHFFFAOYSA-L
Molecular Formula	C4F6O4Pd

132

Ethyl 2-Bromobutyrate 98.0+%, TCI America™

CAS: 533-68-6 Molecular Formula: C6H11BrO2 Molecular Weight (g/mol): 195.06 MDL Number: MFCD00000155 InChI Key: XIMFCGSNSKXPBO-UHFFFAOYNA-N Synonym: ethyl 2-bromobutyrate,dl-ethyl 2-bromobutyrate,2-bromobutanoic acid ethyl ester,butanoic acid, 2-bromo-, ethyl ester,2-bromobutyric acid ethyl ester,ethyl .alpha.-bromobutyrate,2-bromo-butyric acid ethyl ester,butyric acid, 2-bromo-, ethyl ester,2-bromo-butanoicaciethylester,ethyl alpha-bromobutyrate PubChem CID: 79039 IUPAC Name: ethyl 2-bromobutanoate SMILES: CCOC(=O)C(Br)CC

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Specifications

PubChem CID	79039
CAS	533-68-6
Molecular Weight (g/mol)	195.06
MDL Number	MFCD00000155
SMILES	CCOC(=O)C(Br)CC
Synonym	ethyl 2-bromobutyrate,dl-ethyl 2-bromobutyrate,2-bromobutanoic acid ethyl ester,butanoic acid, 2-bromo-, ethyl ester,2-bromobutyric acid ethyl ester,ethyl .alpha.-bromobutyrate,2-bromo-butyric acid ethyl ester,butyric acid, 2-bromo-, ethyl ester,2-bromo-butanoicaciethylester,ethyl alpha-bromobutyrate
IUPAC Name	ethyl 2-bromobutanoate
InChI Key	XIMFCGSNSKXPBO-UHFFFAOYNA-N
Molecular Formula	C6H11BrO2

133

Difluoroacetic Acid 97.0+%, TCI America™

CAS: 381-73-7 Molecular Formula: C2H2F2O2 Molecular Weight (g/mol): 96.033 MDL Number: MFCD00004220 InChI Key: PBWZKZYHONABLN-UHFFFAOYSA-N Synonym: difluoroacetic acid,acetic acid, difluoro,difluoressigsaeure,1,1-difluoroacetic acid,unii-zqk1c95k3n,zqk1c95k3n,acetic acid, 2,2-difluoro,difluoroaceticacid,difluoracetic acid,difluoro-acetic acid PubChem CID: 9788 ChEBI: CHEBI:23716 IUPAC Name: 2,2-difluoroacetic acid SMILES: C(C(=O)O)(F)F

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Specifications

PubChem CID	9788
CAS	381-73-7
Molecular Weight (g/mol)	96.033
ChEBI	CHEBI:23716
MDL Number	MFCD00004220
SMILES	C(C(=O)O)(F)F
Synonym	difluoroacetic acid,acetic acid, difluoro,difluoressigsaeure,1,1-difluoroacetic acid,unii-zqk1c95k3n,zqk1c95k3n,acetic acid, 2,2-difluoro,difluoroaceticacid,difluoracetic acid,difluoro-acetic acid
IUPAC Name	2,2-difluoroacetic acid
InChI Key	PBWZKZYHONABLN-UHFFFAOYSA-N
Molecular Formula	C2H2F2O2

134

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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Specifications

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

135

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

Alpha-halocarboxylic acids and derivatives

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