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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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1 – 15 of 205 results
1

LiChropur™ Difluoroacetic Acid, MilliporeSigma™ Supelco™

CAS: 381-73-7 Molecular Formula: C2H2F2O2 Molecular Weight (g/mol): 96.03 MDL Number: MFCD00004220 InChI Key: PBWZKZYHONABLN-UHFFFAOYSA-N Synonym: DFA IUPAC Name: 2,2-difluoroacetic acid SMILES: OC(=O)C(F)F

CAS 381-73-7
Molecular Weight (g/mol) 96.03
MDL Number MFCD00004220
SMILES OC(=O)C(F)F
Synonym DFA
IUPAC Name 2,2-difluoroacetic acid
InChI Key PBWZKZYHONABLN-UHFFFAOYSA-N
Molecular Formula C2H2F2O2
2

4-Acetyl-2-Fluorobiphenyl, British Pharmacopoeia (BP) Reference Standard, MilliporeSigma™ Supelco™

This product is provided as delivered and specified by the issuing Pharmacopoeia. All information provided in support of this product, including SDS and any product information leaflets, has been developed and issued under the Authority of the issuing Pharmacopoeia.

3

LiChropur™ Ammonium Trifluoroacetate, MilliporeSigma™ Supelco™

CAS: 3336-58-1 Molecular Formula: C2H5F3NO2 Molecular Weight (g/mol): 132.06 MDL Number: MFCD00012615,MFCD03095537 InChI Key: YCNIBOIOWCTRCL-UHFFFAOYSA-O Synonym: Trifluoroacetic acid ammonium salt IUPAC Name: ammonium trifluoroacetic acid SMILES: [NH4+].OC(=O)C(F)(F)F

CAS 3336-58-1
Molecular Weight (g/mol) 132.06
MDL Number MFCD00012615,MFCD03095537
SMILES [NH4+].OC(=O)C(F)(F)F
Synonym Trifluoroacetic acid ammonium salt
IUPAC Name ammonium trifluoroacetic acid
InChI Key YCNIBOIOWCTRCL-UHFFFAOYSA-O
Molecular Formula C2H5F3NO2
4

Gliclazide Impurity F, British Pharmacopoeia (BP) Reference Standard, MilliporeSigma™ Supelco™

This product is provided as delivered and specified by the issuing Pharmacopoeia. All information provided in support of this product, including SDS and any product information leaflets, has been developed and issued under the Authority of the issuing Pharmacopoeia.

5

Triprolidine Hydrochloride, British Pharmacopoeia (BP) Reference Standard, MilliporeSigma™ Supelco™

This product is provided as delivered and specified by the issuing Pharmacopoeia. All information provided in support of this product, including SDS and any product information leaflets, has been developed and issued under the Authority of the issuing Pharmacopoeia.

6

Difluoroacetic acid, 98%

CAS: 381-73-7 Molecular Formula: C2H2F2O2 Molecular Weight (g/mol): 96.03 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

PubChem CID 9788
CAS 381-73-7
Molecular Weight (g/mol) 96.03
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
7

Iodoacetic acid, sodium salt, 99%

CAS: 305-53-3 Molecular Formula: C2H2INaO2 Molecular Weight (g/mol): 207.93 MDL Number: MFCD00002686 InChI Key: AGDSCTQQXMDDCV-UHFFFAOYSA-M Synonym: sodium iodoacetate,iodoacetic acid sodium salt,acetic acid, iodo-, sodium salt,sodium 2-iodoacetate,sodium monoiodoacetate,iodoacetate, sodium salt,sodium iodacetate,iodoacetic acid, sodium salt,unii-07814f2qri,ccris 9232 PubChem CID: 5239 IUPAC Name: sodium;2-iodoacetate SMILES: C(C(=O)[O-])I.[Na+]

PubChem CID 5239
CAS 305-53-3
Molecular Weight (g/mol) 207.93
MDL Number MFCD00002686
SMILES C(C(=O)[O-])I.[Na+]
Synonym sodium iodoacetate,iodoacetic acid sodium salt,acetic acid, iodo-, sodium salt,sodium 2-iodoacetate,sodium monoiodoacetate,iodoacetate, sodium salt,sodium iodacetate,iodoacetic acid, sodium salt,unii-07814f2qri,ccris 9232
IUPAC Name sodium;2-iodoacetate
InChI Key AGDSCTQQXMDDCV-UHFFFAOYSA-M
Molecular Formula C2H2INaO2
8

2-Fluoropropionic acid, 96%, Thermo Scientific Chemicals

CAS: 6087-13-4 Molecular Formula: C3H5FO2 Molecular Weight (g/mol): 92.069 MDL Number: MFCD06247714 InChI Key: ZVZPFTCEXIGSHM-UHFFFAOYSA-N Synonym: 2-fluoropropionic acid,2-fluoro-propionic acid,propanoic acid, 2-fluoro,pubchem13698,propanoic acid,2-fluoro,acmc-1b20x,ksc492i2p PubChem CID: 256876 IUPAC Name: 2-fluoropropanoic acid SMILES: CC(C(=O)O)F

PubChem CID 256876
CAS 6087-13-4
Molecular Weight (g/mol) 92.069
MDL Number MFCD06247714
SMILES CC(C(=O)O)F
Synonym 2-fluoropropionic acid,2-fluoro-propionic acid,propanoic acid, 2-fluoro,pubchem13698,propanoic acid,2-fluoro,acmc-1b20x,ksc492i2p
IUPAC Name 2-fluoropropanoic acid
InChI Key ZVZPFTCEXIGSHM-UHFFFAOYSA-N
Molecular Formula C3H5FO2
9

tert-Butyl chloroacetate, 97%

CAS: 107-59-5 Molecular Formula: C6H11ClO2 Molecular Weight (g/mol): 150 MDL Number: MFCD00000930 InChI Key: KUYMVWXKHQSIAS-UHFFFAOYSA-N Synonym: tert-butyl chloroacetate,chloroacetic acid tert-butyl ester,acetic acid, chloro-, 1,1-dimethylethyl ester,t-butyl chloroacetate,tert-butylchloroacetate,acetic acid, chloro-, tert-butyl ester,chloroacetic acid t-butyl ester,acetic acid, 2-chloro-, 1,1-dimethylethyl ester,t-butylchloroacetate,t-butyl-chloroacetate PubChem CID: 66052 IUPAC Name: tert-butyl 2-chloroacetate SMILES: CC(C)(C)OC(=O)CCl

PubChem CID 66052
CAS 107-59-5
Molecular Weight (g/mol) 150
MDL Number MFCD00000930
SMILES CC(C)(C)OC(=O)CCl
Synonym tert-butyl chloroacetate,chloroacetic acid tert-butyl ester,acetic acid, chloro-, 1,1-dimethylethyl ester,t-butyl chloroacetate,tert-butylchloroacetate,acetic acid, chloro-, tert-butyl ester,chloroacetic acid t-butyl ester,acetic acid, 2-chloro-, 1,1-dimethylethyl ester,t-butylchloroacetate,t-butyl-chloroacetate
IUPAC Name tert-butyl 2-chloroacetate
InChI Key KUYMVWXKHQSIAS-UHFFFAOYSA-N
Molecular Formula C6H11ClO2
10

Ethyl bromodifluoroacetate, 98%

CAS: 667-27-6 Molecular Formula: C4H5BrF2O2 Molecular Weight (g/mol): 202.99 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

PubChem CID 69585
CAS 667-27-6
Molecular Weight (g/mol) 202.99
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
11

(S)-(-)-2-Bromopropionic acid, 98%, >85% ee

CAS: 32644-15-8 Molecular Formula: C3H5BrO2 Molecular Weight (g/mol): 152.98 MDL Number: MFCD00137325 InChI Key: MONMFXREYOKQTI-REOHCLBHSA-N Synonym: s---2-bromopropionic acid,s-2-bromopropionic acid,2s-2-bromopropanoic acid,s-2-bromopropanoic acid,l-2-bromopropionic acid,s---2-bromopropionicacid,l-alpha-bromopropionic acid,2s---2-bromopropionic acid,s-alpha-bromopropionic acid PubChem CID: 642232 IUPAC Name: (2S)-2-bromopropanoic acid SMILES: CC(C(=O)O)Br

PubChem CID 642232
CAS 32644-15-8
Molecular Weight (g/mol) 152.98
MDL Number MFCD00137325
SMILES CC(C(=O)O)Br
Synonym s---2-bromopropionic acid,s-2-bromopropionic acid,2s-2-bromopropanoic acid,s-2-bromopropanoic acid,l-2-bromopropionic acid,s---2-bromopropionicacid,l-alpha-bromopropionic acid,2s---2-bromopropionic acid,s-alpha-bromopropionic acid
IUPAC Name (2S)-2-bromopropanoic acid
InChI Key MONMFXREYOKQTI-REOHCLBHSA-N
Molecular Formula C3H5BrO2
12

Bromoacetic anhydride, 95%

CAS: 13094-51-4 Molecular Formula: C4H4Br2O3 Molecular Weight (g/mol): 259.87 MDL Number: MFCD00045041 InChI Key: FUKOTTQGWQVMQB-UHFFFAOYSA-N Synonym: bromoacetic anhydride,2-bromoacetic anhydride,acetic acid, 2-bromo-,1,1'-anhydride,2-bromoacetyl 2-bromoacetate,bromoaceticanhydride,acetic acid, bromo-, anhydride PubChem CID: 4259817 IUPAC Name: (2-bromoacetyl) 2-bromoacetate SMILES: C(C(=O)OC(=O)CBr)Br

PubChem CID 4259817
CAS 13094-51-4
Molecular Weight (g/mol) 259.87
MDL Number MFCD00045041
SMILES C(C(=O)OC(=O)CBr)Br
Synonym bromoacetic anhydride,2-bromoacetic anhydride,acetic acid, 2-bromo-,1,1'-anhydride,2-bromoacetyl 2-bromoacetate,bromoaceticanhydride,acetic acid, bromo-, anhydride
IUPAC Name (2-bromoacetyl) 2-bromoacetate
InChI Key FUKOTTQGWQVMQB-UHFFFAOYSA-N
Molecular Formula C4H4Br2O3
13

Ethyl bromofluoroacetate, 97%

CAS: 401-55-8 Molecular Formula: C4H6BrFO2 Molecular Weight (g/mol): 184.992 MDL Number: MFCD00042095 InChI Key: ULNDTPIRBQGESN-UHFFFAOYSA-N Synonym: ethyl bromofluoroacetate,bromofluoroacetic acid ethyl ester,ethyl-2-bromofluoroacetate,ethylbromofluoroacetate,acetic acid, bromofluoro-, ethyl ester,bromofluoroacetate,ethyl fluorobromoacetate,acmc-209jb9,ksc236i3t PubChem CID: 2733407 IUPAC Name: ethyl 2-bromo-2-fluoroacetate SMILES: CCOC(=O)C(F)Br

PubChem CID 2733407
CAS 401-55-8
Molecular Weight (g/mol) 184.992
MDL Number MFCD00042095
SMILES CCOC(=O)C(F)Br
Synonym ethyl bromofluoroacetate,bromofluoroacetic acid ethyl ester,ethyl-2-bromofluoroacetate,ethylbromofluoroacetate,acetic acid, bromofluoro-, ethyl ester,bromofluoroacetate,ethyl fluorobromoacetate,acmc-209jb9,ksc236i3t
IUPAC Name ethyl 2-bromo-2-fluoroacetate
InChI Key ULNDTPIRBQGESN-UHFFFAOYSA-N
Molecular Formula C4H6BrFO2
14

Isopropyl bromoacetate, 97%

CAS: 29921-57-1 Molecular Formula: C5H9BrO2 Molecular Weight (g/mol): 181.03 MDL Number: MFCD00009886 InChI Key: JCWLEWKPXYZHGQ-UHFFFAOYSA-N Synonym: isopropyl bromoacetate,acetic acid, bromo-, 1-methylethyl ester,acetic acid, 2-bromo-, 1-methylethyl ester,isopropyl 2-bromoacetate,brch2c o och ch3 2,bromoacetic acid isopropyl ester,i-propyl bromoacetate,acmc-1ciu8,isopropyl .alpha.-bromoacetate PubChem CID: 121593 IUPAC Name: propan-2-yl 2-bromoacetate SMILES: CC(C)OC(=O)CBr

PubChem CID 121593
CAS 29921-57-1
Molecular Weight (g/mol) 181.03
MDL Number MFCD00009886
SMILES CC(C)OC(=O)CBr
Synonym isopropyl bromoacetate,acetic acid, bromo-, 1-methylethyl ester,acetic acid, 2-bromo-, 1-methylethyl ester,isopropyl 2-bromoacetate,brch2c o och ch3 2,bromoacetic acid isopropyl ester,i-propyl bromoacetate,acmc-1ciu8,isopropyl .alpha.-bromoacetate
IUPAC Name propan-2-yl 2-bromoacetate
InChI Key JCWLEWKPXYZHGQ-UHFFFAOYSA-N
Molecular Formula C5H9BrO2
15

(S)-(-)-2-Chloropropionic acid, 98%

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-chloropropanoic acid SMILES: C[C@H](Cl)C([O-])=O

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-chloropropanoic acid
InChI Key GAWAYYRQGQZKCR-REOHCLBHSA-M
Molecular Formula C3H4ClO2