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.

61 – 75 of 477 results

Methyl alpha-bromophenylacetate, 97+%

CAS: 3042-81-7 Molecular Formula: C₉H₉BrO₂ Molecular Weight (g/mol): 229.07 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)	229.07
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

Chloroacetic acid, 99+%, ACS reagent

CAS: 79-11-8 Molecular Formula: C₂H₃ClO₂ Molecular Weight (g/mol): 94.5 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)	94.5
ChEBI	CHEBI:27869
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

Benzyl chloroacetate, 98%

CAS: 140-18-1 Molecular Formula: C₉H₉ClO₂ Molecular Weight (g/mol): 184.62 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)	184.62
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

Ethyl iodoacetate, 98%, stabilized, Thermo Scientific Chemicals

CAS: 623-48-3 Molecular Formula: C4H7IO2 Molecular Weight (g/mol): 214.00 MDL Number: MFCD00001081 InChI Key: MFFXVVHUKRKXCI-UHFFFAOYSA-N Synonym: ethyl iodoacetate,acetic acid, iodo-, ethyl ester,ethyl monoiodoacetate,iodoacetic acid, ethyl ester,acetic acid, 2-iodo-, ethyl ester,ethylester kyseliny jodoctove czech,acetic acid, 2-iodo-,ethyl ester,ethylester kyseliny jodoctove,ethyliodoacetate,iodoacetic acid ethyl PubChem CID: 12183 IUPAC Name: ethyl 2-iodoacetate SMILES: CCOC(=O)CI

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Specifications

PubChem CID	12183
CAS	623-48-3
Molecular Weight (g/mol)	214.00
MDL Number	MFCD00001081
SMILES	CCOC(=O)CI
Synonym	ethyl iodoacetate,acetic acid, iodo-, ethyl ester,ethyl monoiodoacetate,iodoacetic acid, ethyl ester,acetic acid, 2-iodo-, ethyl ester,ethylester kyseliny jodoctove czech,acetic acid, 2-iodo-,ethyl ester,ethylester kyseliny jodoctove,ethyliodoacetate,iodoacetic acid ethyl
IUPAC Name	ethyl 2-iodoacetate
InChI Key	MFFXVVHUKRKXCI-UHFFFAOYSA-N
Molecular Formula	C4H7IO2

2,2-Difluoropropionic acid, 97%, Thermo Scientific Chemicals

CAS: 373-96-6 Molecular Formula: C3H4F2O2 Molecular Weight (g/mol): 110.06 MDL Number: MFCD03093764 InChI Key: PMWGIVRHUIAIII-UHFFFAOYSA-N Synonym: 2,2-difluoropropionic acid,2,2-difluoropropionicacid,2,2-difluoro-propionic acid,propanoic acid, 2,2-difluoro,acmc-1ctsu,2,2-difluorpropionic acid PubChem CID: 2782825 IUPAC Name: 2,2-difluoropropanoic acid SMILES: CC(F)(F)C(O)=O

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Specifications

PubChem CID	2782825
CAS	373-96-6
Molecular Weight (g/mol)	110.06
MDL Number	MFCD03093764
SMILES	CC(F)(F)C(O)=O
Synonym	2,2-difluoropropionic acid,2,2-difluoropropionicacid,2,2-difluoro-propionic acid,propanoic acid, 2,2-difluoro,acmc-1ctsu,2,2-difluorpropionic acid
IUPAC Name	2,2-difluoropropanoic acid
InChI Key	PMWGIVRHUIAIII-UHFFFAOYSA-N
Molecular Formula	C3H4F2O2

Benzyl bromoacetate, 97%

CAS: 5437-45-6 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD00000190 InChI Key: JHVLLYQQQYIWKX-UHFFFAOYSA-N Synonym: benzyl bromoacetate,bromoacetic acid benzyl ester,acetic acid, bromo-, phenylmethyl ester,merbac 35,caswell no. 082a,acetic acid, bromo-, benzyl ester,unii-64u2rk18d3,phenylmethyl 2-bromoacetate,epa pesticide chemical code 008710,benzyl bromacetate PubChem CID: 62576 IUPAC Name: benzyl 2-bromoacetate SMILES: C1=CC=C(C=C1)COC(=O)CBr

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Specifications

PubChem CID	62576
CAS	5437-45-6
Molecular Weight (g/mol)	229.073
MDL Number	MFCD00000190
SMILES	C1=CC=C(C=C1)COC(=O)CBr
Synonym	benzyl bromoacetate,bromoacetic acid benzyl ester,acetic acid, bromo-, phenylmethyl ester,merbac 35,caswell no. 082a,acetic acid, bromo-, benzyl ester,unii-64u2rk18d3,phenylmethyl 2-bromoacetate,epa pesticide chemical code 008710,benzyl bromacetate
IUPAC Name	benzyl 2-bromoacetate
InChI Key	JHVLLYQQQYIWKX-UHFFFAOYSA-N
Molecular Formula	C9H9BrO2

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

(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

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

n-Propyl bromoacetate, 97%

CAS: 35223-80-4 Molecular Formula: C5H9BrO2 Molecular Weight (g/mol): 181.03 MDL Number: MFCD00075247 InChI Key: ISYUCUGTDNJIHV-UHFFFAOYSA-N Synonym: propyl bromoacetate,n-propyl bromoacetate,acetic acid, bromo-, propyl ester,acmc-1ajeq,bromoacetic acid propyl ester,bromo-acetic acid propyl ester,acetic acid, 2-bromo-,propyl ester PubChem CID: 141981 IUPAC Name: propyl 2-bromoacetate SMILES: CCCOC(=O)CBr

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Specifications

PubChem CID	141981
CAS	35223-80-4
Molecular Weight (g/mol)	181.03
MDL Number	MFCD00075247
SMILES	CCCOC(=O)CBr
Synonym	propyl bromoacetate,n-propyl bromoacetate,acetic acid, bromo-, propyl ester,acmc-1ajeq,bromoacetic acid propyl ester,bromo-acetic acid propyl ester,acetic acid, 2-bromo-,propyl ester
IUPAC Name	propyl 2-bromoacetate
InChI Key	ISYUCUGTDNJIHV-UHFFFAOYSA-N
Molecular Formula	C5H9BrO2

tert-Butyl 2-bromobutyrate, 98%

CAS: 24457-21-4 Molecular Formula: C8H15BrO2 Molecular Weight (g/mol): 223.11 MDL Number: MFCD00209634 InChI Key: RIUJWUWLGXBICR-UHFFFAOYSA-N Synonym: tert-butyl 2-bromobutyrate,tert-butyl2-bromobutanoate,t-butyl 2-bromobutyrate,2-bromobutyric acid tert-butyl ester,2-bromobutanoic acid tert-butyl ester,butanoic acid, 2-bromo-, 1,1-dimethylethyl ester,tertbutyl 2-bromobutyrate,tert-butyl-2-bromobutyrat,acmc-1cb0d,tert-butyl-2-bromobutyrate PubChem CID: 13124118 IUPAC Name: tert-butyl 2-bromobutanoate SMILES: CCC(C(=O)OC(C)(C)C)Br

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Specifications

PubChem CID	13124118
CAS	24457-21-4
Molecular Weight (g/mol)	223.11
MDL Number	MFCD00209634
SMILES	CCC(C(=O)OC(C)(C)C)Br
Synonym	tert-butyl 2-bromobutyrate,tert-butyl2-bromobutanoate,t-butyl 2-bromobutyrate,2-bromobutyric acid tert-butyl ester,2-bromobutanoic acid tert-butyl ester,butanoic acid, 2-bromo-, 1,1-dimethylethyl ester,tertbutyl 2-bromobutyrate,tert-butyl-2-bromobutyrat,acmc-1cb0d,tert-butyl-2-bromobutyrate
IUPAC Name	tert-butyl 2-bromobutanoate
InChI Key	RIUJWUWLGXBICR-UHFFFAOYSA-N
Molecular Formula	C8H15BrO2

Sodium bromoacetate, 98%

CAS: 1068-52-6 Molecular Formula: C2H2BrNaO2 Molecular Weight (g/mol): 160.93 MDL Number: MFCD01311832 InChI Key: SESSOVUNEZQNBV-UHFFFAOYSA-M Synonym: sodium bromoacetate,sodium 2-bromoacetate,sodium monobromoacetate,unii-8j155ck8pv,acetic acid, bromo-, sodium salt,bromoacetic acid sodium salt,acmc-1bowb,sodium bromoacetate, ?brch2coona,acetic acid,bromo-,sodium salt 8ci,9ci,acetic acid, bromo-,sodium salt 8ci,9ci PubChem CID: 23675628 IUPAC Name: sodium;2-bromoacetate SMILES: C(C(=O)[O-])Br.[Na+]

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Specifications

PubChem CID	23675628
CAS	1068-52-6
Molecular Weight (g/mol)	160.93
MDL Number	MFCD01311832
SMILES	C(C(=O)[O-])Br.[Na+]
Synonym	sodium bromoacetate,sodium 2-bromoacetate,sodium monobromoacetate,unii-8j155ck8pv,acetic acid, bromo-, sodium salt,bromoacetic acid sodium salt,acmc-1bowb,sodium bromoacetate, ?brch2coona,acetic acid,bromo-,sodium salt 8ci,9ci,acetic acid, bromo-,sodium salt 8ci,9ci
IUPAC Name	sodium;2-bromoacetate
InChI Key	SESSOVUNEZQNBV-UHFFFAOYSA-M
Molecular Formula	C2H2BrNaO2

Diethyl tetrafluorosuccinate, 97%

CAS: 377-71-9 Molecular Formula: C8H10F4O4 Molecular Weight (g/mol): 246.158 MDL Number: MFCD00015155 InChI Key: BLZSSBPZHBFNBN-UHFFFAOYSA-N Synonym: diethyl tetrafluorosuccinate,diethyl perfluorosuccinate,butanedioic acid, tetrafluoro-, diethyl ester,diethyl 2,2,3,3-tetrafluorosuccinate,butanedioic acid, 2,2,3,3-tetrafluoro-, 1,4-diethyl ester,1,4-diethyl 2,2,3,3-tetrafluorobutanedioate,diethyl 2,2,3,3-tetrafluorobutane-1,4-dioate,diethyltetrafluorosuccinate,ethyl perfluorosuccinate,acmc-1cqkj PubChem CID: 67834 IUPAC Name: diethyl 2,2,3,3-tetrafluorobutanedioate SMILES: CCOC(=O)C(C(C(=O)OCC)(F)F)(F)F

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Specifications

PubChem CID	67834
CAS	377-71-9
Molecular Weight (g/mol)	246.158
MDL Number	MFCD00015155
SMILES	CCOC(=O)C(C(C(=O)OCC)(F)F)(F)F
Synonym	diethyl tetrafluorosuccinate,diethyl perfluorosuccinate,butanedioic acid, tetrafluoro-, diethyl ester,diethyl 2,2,3,3-tetrafluorosuccinate,butanedioic acid, 2,2,3,3-tetrafluoro-, 1,4-diethyl ester,1,4-diethyl 2,2,3,3-tetrafluorobutanedioate,diethyl 2,2,3,3-tetrafluorobutane-1,4-dioate,diethyltetrafluorosuccinate,ethyl perfluorosuccinate,acmc-1cqkj
IUPAC Name	diethyl 2,2,3,3-tetrafluorobutanedioate
InChI Key	BLZSSBPZHBFNBN-UHFFFAOYSA-N
Molecular Formula	C8H10F4O4

Diethyl bromomalonate, 90+%

CAS: 685-87-0 Molecular Formula: C₇H₁₁BrO₄ Molecular Weight (g/mol): 239.07 MDL Number: MFCD00009138 InChI Key: FNJVDWXUKLTFFL-UHFFFAOYSA-N Synonym: diethyl bromomalonate,diethyl 2-bromomalonate,bromomalonic acid diethyl ester,ethyl bromomalonate,diethylbromomalonate,propanedioic acid, bromo-, diethyl ester,1,3-diethyl 2-bromopropanedioate,diethyl bromopropanedioate,malonic acid, bromo-, diethyl ester,propanedioic acid, 2-bromo-, 1,3-diethyl ester PubChem CID: 69637 IUPAC Name: diethyl 2-bromopropanedioate SMILES: CCOC(=O)C(C(=O)OCC)Br

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Specifications

PubChem CID	69637
CAS	685-87-0
Molecular Weight (g/mol)	239.07
MDL Number	MFCD00009138
SMILES	CCOC(=O)C(C(=O)OCC)Br
Synonym	diethyl bromomalonate,diethyl 2-bromomalonate,bromomalonic acid diethyl ester,ethyl bromomalonate,diethylbromomalonate,propanedioic acid, bromo-, diethyl ester,1,3-diethyl 2-bromopropanedioate,diethyl bromopropanedioate,malonic acid, bromo-, diethyl ester,propanedioic acid, 2-bromo-, 1,3-diethyl ester
IUPAC Name	diethyl 2-bromopropanedioate
InChI Key	FNJVDWXUKLTFFL-UHFFFAOYSA-N
Molecular Formula	C₇H₁₁BrO₄

Iodoacetic acid, 97%

CAS: 64-69-7 Molecular Formula: C₂H₃IO₂ Molecular Weight (g/mol): 185.95 MDL Number: MFCD00002685 InChI Key: JDNTWHVOXJZDSN-UHFFFAOYSA-N Synonym: iodoacetic acid,acetic acid, iodo,iodoacetate,monoiodoacetic acid,monoiodoacetate,monoiodine acetate,iodoaceticacid,iodoethanoic acid,acetic acid, 2-iodo,kyselina jodoctova PubChem CID: 5240 ChEBI: CHEBI:74571 IUPAC Name: 2-iodoacetic acid SMILES: C(C(=O)O)I

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Specifications

PubChem CID	5240
CAS	64-69-7
Molecular Weight (g/mol)	185.95
ChEBI	CHEBI:74571
MDL Number	MFCD00002685
SMILES	C(C(=O)O)I
Synonym	iodoacetic acid,acetic acid, iodo,iodoacetate,monoiodoacetic acid,monoiodoacetate,monoiodine acetate,iodoaceticacid,iodoethanoic acid,acetic acid, 2-iodo,kyselina jodoctova
IUPAC Name	2-iodoacetic acid
InChI Key	JDNTWHVOXJZDSN-UHFFFAOYSA-N
Molecular Formula	C₂H₃IO₂

Ethyl 2-fluoroisobutyrate, 97%, Thermo Scientific Chemicals

CAS: 55816-69-8 Molecular Formula: C6H11FO2 Molecular Weight (g/mol): 134.15 MDL Number: MFCD08062432 InChI Key: CJRQQJKWNULSFQ-UHFFFAOYSA-N Synonym: ethyl 2-fluoroisobutyrate,propanoic acid, 2-fluoro-2-methyl-, ethyl ester,ethyl 2-fluoro-isobutyrate,ethyl 2-fluoro-2-methylpropionate,2-fluoro-2-methylpropionic acid ethyl ester PubChem CID: 10898763 IUPAC Name: ethyl 2-fluoro-2-methylpropanoate SMILES: CCOC(=O)C(C)(C)F

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Specifications

PubChem CID	10898763
CAS	55816-69-8
Molecular Weight (g/mol)	134.15
MDL Number	MFCD08062432
SMILES	CCOC(=O)C(C)(C)F
Synonym	ethyl 2-fluoroisobutyrate,propanoic acid, 2-fluoro-2-methyl-, ethyl ester,ethyl 2-fluoro-isobutyrate,ethyl 2-fluoro-2-methylpropionate,2-fluoro-2-methylpropionic acid ethyl ester
IUPAC Name	ethyl 2-fluoro-2-methylpropanoate
InChI Key	CJRQQJKWNULSFQ-UHFFFAOYSA-N
Molecular Formula	C6H11FO2

Alpha-halocarboxylic acids and derivatives

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