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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 de 203 résultats
1

DL-2-Bromopropionic acid, 99%

CAS: 598-72-1 Formule moléculaire: C3H5BrO2 Poids moléculaire (g/mol): 152.98 Numéro MDL: MFCD00004211,MFCD00145205 Clé InChI: MONMFXREYOKQTI-UHFFFAOYNA-N Synonyme: 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 CID PubChem: 11729 Nom IUPAC: 2-bromopropanoic acid SMILES: CC(Br)C(O)=O

Poids moléculaire (g/mol) 152.98
Synonyme 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
Numéro MDL MFCD00004211,MFCD00145205
CAS 598-72-1
CID PubChem 11729
Nom IUPAC 2-bromopropanoic acid
Clé InChI MONMFXREYOKQTI-UHFFFAOYNA-N
SMILES CC(Br)C(O)=O
Formule moléculaire C3H5BrO2
2

2-Chloro-2-ethoxyacetic acid ethyl ester, 90%, remainder mainly ethyl diethoxyacetat, Thermo Scientific Chemicals

CAS: 34006-60-5 Formule moléculaire: C6H11ClO3 Poids moléculaire (g/mol): 166.60 Numéro MDL: MFCD00043953 Clé InChI: WDCHMODANTVRTF-UHFFFAOYNA-N Synonyme: 2-chloro-2-ethoxyacetic acid ethyl ester,ethyl 2-chloro-2-ethoxy-acetate,ethyl2-chloro-2-ethoxyacetate,ethyl chloro ethoxy acetate,chloro ethoxy acetic acid ethyl ester,ethyl alpha-chloro-alpha-ethoxyacetate,ethyl alpha-chloro-alpha-ethoxy-acetate,2-chloro-2-ethoxy-acetic acid ethyl ester,acetic acid,2-chloro-2-ethoxy-, ethyl ester CID PubChem: 2724873 Nom IUPAC: ethyl 2-(1-chloroethoxy)acetate SMILES: CCOC(=O)COC(C)Cl

Poids moléculaire (g/mol) 166.60
Synonyme 2-chloro-2-ethoxyacetic acid ethyl ester,ethyl 2-chloro-2-ethoxy-acetate,ethyl2-chloro-2-ethoxyacetate,ethyl chloro ethoxy acetate,chloro ethoxy acetic acid ethyl ester,ethyl alpha-chloro-alpha-ethoxyacetate,ethyl alpha-chloro-alpha-ethoxy-acetate,2-chloro-2-ethoxy-acetic acid ethyl ester,acetic acid,2-chloro-2-ethoxy-, ethyl ester
Numéro MDL MFCD00043953
CAS 34006-60-5
CID PubChem 2724873
Nom IUPAC ethyl 2-(1-chloroethoxy)acetate
Clé InChI WDCHMODANTVRTF-UHFFFAOYNA-N
SMILES CCOC(=O)COC(C)Cl
Formule moléculaire C6H11ClO3
3

Chloroacetic acid, 99+%, ACS reagent

CAS: 79-11-8 Formule moléculaire: C2H3ClO2 Poids moléculaire (g/mol): 94.5 Clé InChI: FOCAUTSVDIKZOP-UHFFFAOYSA-N Synonyme: chloroacetic acid,monochloroacetic acid,chloracetic acid,acetic acid, chloro,acide chloracetique,chloroethanoic acid,monochloroethanoic acid,monochloracetic acid,monochloorazijnzuur,monochloressigsaeure CID PubChem: 300 ChEBI: CHEBI:27869 Nom IUPAC: 2-chloroacetic acid SMILES: C(C(=O)O)Cl

Poids moléculaire (g/mol) 94.5
Synonyme chloroacetic acid,monochloroacetic acid,chloracetic acid,acetic acid, chloro,acide chloracetique,chloroethanoic acid,monochloroethanoic acid,monochloracetic acid,monochloorazijnzuur,monochloressigsaeure
CAS 79-11-8
CID PubChem 300
ChEBI CHEBI:27869
Nom IUPAC 2-chloroacetic acid
Clé InChI FOCAUTSVDIKZOP-UHFFFAOYSA-N
SMILES C(C(=O)O)Cl
Formule moléculaire C2H3ClO2
4

Bromoacetic anhydride, 95%

CAS: 13094-51-4 Formule moléculaire: C4H4Br2O3 Poids moléculaire (g/mol): 259.87 Numéro MDL: MFCD00045041 Clé InChI: FUKOTTQGWQVMQB-UHFFFAOYSA-N Synonyme: bromoacetic anhydride,2-bromoacetic anhydride,acetic acid, 2-bromo-,1,1'-anhydride,2-bromoacetyl 2-bromoacetate,bromoaceticanhydride,acetic acid, bromo-, anhydride CID PubChem: 4259817 Nom IUPAC: (2-bromoacetyl) 2-bromoacetate SMILES: C(C(=O)OC(=O)CBr)Br

Poids moléculaire (g/mol) 259.87
Synonyme bromoacetic anhydride,2-bromoacetic anhydride,acetic acid, 2-bromo-,1,1'-anhydride,2-bromoacetyl 2-bromoacetate,bromoaceticanhydride,acetic acid, bromo-, anhydride
Numéro MDL MFCD00045041
CAS 13094-51-4
CID PubChem 4259817
Nom IUPAC (2-bromoacetyl) 2-bromoacetate
Clé InChI FUKOTTQGWQVMQB-UHFFFAOYSA-N
SMILES C(C(=O)OC(=O)CBr)Br
Formule moléculaire C4H4Br2O3
5

Diethyl tetrafluorosuccinate, 97%

CAS: 377-71-9 Formule moléculaire: C8H10F4O4 Poids moléculaire (g/mol): 246.158 Numéro MDL: MFCD00015155 Clé InChI: BLZSSBPZHBFNBN-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 67834 Nom IUPAC: diethyl 2,2,3,3-tetrafluorobutanedioate SMILES: CCOC(=O)C(C(C(=O)OCC)(F)F)(F)F

Poids moléculaire (g/mol) 246.158
Synonyme 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
Numéro MDL MFCD00015155
CAS 377-71-9
CID PubChem 67834
Nom IUPAC diethyl 2,2,3,3-tetrafluorobutanedioate
Clé InChI BLZSSBPZHBFNBN-UHFFFAOYSA-N
SMILES CCOC(=O)C(C(C(=O)OCC)(F)F)(F)F
Formule moléculaire C8H10F4O4
6

Diethyl difluoromalonate, 97%

CAS: 680-65-9 Formule moléculaire: C7H10F2O4 Poids moléculaire (g/mol): 196.15 Numéro MDL: MFCD00221617 Clé InChI: WCRVWLHTROHXBB-UHFFFAOYSA-N Synonyme: diethyl 2,2-difluoromalonate,diethyl difluoromalonate,2,2-difluoro-malonic acid diethyl ester,1,3-diethyl 2,2-difluoropropanedioate,difluoromalonic acid diethyl ester,diethyl2,2-difluoromalonate,propanedioic acid, 2,2-difluoro-, 1,3-diethyl ester,propanedioic acid, difluoro-, diethyl ester,diethyl 2,2-difluoromalonate #,diethyl2,2-difluoropropanedioatev CID PubChem: 260648 Nom IUPAC: diethyl 2,2-difluoropropanedioate SMILES: CCOC(=O)C(F)(F)C(=O)OCC

Poids moléculaire (g/mol) 196.15
Synonyme diethyl 2,2-difluoromalonate,diethyl difluoromalonate,2,2-difluoro-malonic acid diethyl ester,1,3-diethyl 2,2-difluoropropanedioate,difluoromalonic acid diethyl ester,diethyl2,2-difluoromalonate,propanedioic acid, 2,2-difluoro-, 1,3-diethyl ester,propanedioic acid, difluoro-, diethyl ester,diethyl 2,2-difluoromalonate #,diethyl2,2-difluoropropanedioatev
Numéro MDL MFCD00221617
CAS 680-65-9
CID PubChem 260648
Nom IUPAC diethyl 2,2-difluoropropanedioate
Clé InChI WCRVWLHTROHXBB-UHFFFAOYSA-N
SMILES CCOC(=O)C(F)(F)C(=O)OCC
Formule moléculaire C7H10F2O4
7

Ethyl 2-bromoisobutyrate, 98+%

CAS: 600-00-0 Formule moléculaire: C6H11BrO2 Poids moléculaire (g/mol): 195.06 Numéro MDL: MFCD00000123 Clé InChI: IOLQWGVDEFWYNP-UHFFFAOYSA-N Synonyme: ethyl 2-bromoisobutyrate,ethyl 2-bromo-2-methylpropionate,ethyl alpha-bromoisobutyrate,ethyl .alpha.-bromoisobutyrate,propanoic acid, 2-bromo-2-methyl-, ethyl ester,2-bromo-2-methylpropanoic acid, ethyl ester,ethyl-2-bromoisobutyrate,propanoic acid, bromo-2-methyl-, ethyl ester,ethyl 2-bromo-2-methyl-propanoate,propionic acid, 2-bromo-2-methyl-, ethyl ester CID PubChem: 11745 Nom IUPAC: ethyl 2-bromo-2-methylpropanoate SMILES: CCOC(=O)C(C)(C)Br

Poids moléculaire (g/mol) 195.06
Synonyme ethyl 2-bromoisobutyrate,ethyl 2-bromo-2-methylpropionate,ethyl alpha-bromoisobutyrate,ethyl .alpha.-bromoisobutyrate,propanoic acid, 2-bromo-2-methyl-, ethyl ester,2-bromo-2-methylpropanoic acid, ethyl ester,ethyl-2-bromoisobutyrate,propanoic acid, bromo-2-methyl-, ethyl ester,ethyl 2-bromo-2-methyl-propanoate,propionic acid, 2-bromo-2-methyl-, ethyl ester
Numéro MDL MFCD00000123
CAS 600-00-0
CID PubChem 11745
Nom IUPAC ethyl 2-bromo-2-methylpropanoate
Clé InChI IOLQWGVDEFWYNP-UHFFFAOYSA-N
SMILES CCOC(=O)C(C)(C)Br
Formule moléculaire C6H11BrO2
8

tert-Butyl bromoacetate, 98%

CAS: 5292-43-3 Formule moléculaire: C6H11BrO2 Poids moléculaire (g/mol): 195.06 Numéro MDL: MFCD00000188 Clé InChI: BNWCETAHAJSBFG-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 79177 Nom IUPAC: tert-butyl 2-bromoacetate SMILES: CC(C)(C)OC(=O)CBr

Poids moléculaire (g/mol) 195.06
Synonyme 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
Numéro MDL MFCD00000188
CAS 5292-43-3
CID PubChem 79177
Nom IUPAC tert-butyl 2-bromoacetate
Clé InChI BNWCETAHAJSBFG-UHFFFAOYSA-N
SMILES CC(C)(C)OC(=O)CBr
Formule moléculaire C6H11BrO2
9

Ethyl 2-bromoisovalerate, 97%

CAS: 609-12-1 Formule moléculaire: C7H13BrO2 Poids moléculaire (g/mol): 209.083 Numéro MDL: MFCD00026855 Clé InChI: WNFUWONOILPKNX-UHFFFAOYSA-N Synonyme: ethyl 2-bromoisovalerate,ethyl 2-bromo isovalerate,ethyl 2-bromo-3-methylbutyrate,ethyl .alpha.-bromoisovalerate,ethyl .alpha.-bromoisovalerate,2-bromoisovaleric acid ethyl ester,ethyl 2-bromo-3-methyl-butanoate,.alpha.-bromoisovaleric acid ethyl ester,ethyl,a-bromoisovalerate,a-bromoisovalerate CID PubChem: 79068 Nom IUPAC: ethyl 2-bromo-3-methylbutanoate SMILES: CCOC(=O)C(C(C)C)Br

Poids moléculaire (g/mol) 209.083
Synonyme ethyl 2-bromoisovalerate,ethyl 2-bromo isovalerate,ethyl 2-bromo-3-methylbutyrate,ethyl .alpha.-bromoisovalerate,ethyl .alpha.-bromoisovalerate,2-bromoisovaleric acid ethyl ester,ethyl 2-bromo-3-methyl-butanoate,.alpha.-bromoisovaleric acid ethyl ester,ethyl,a-bromoisovalerate,a-bromoisovalerate
Numéro MDL MFCD00026855
CAS 609-12-1
CID PubChem 79068
Nom IUPAC ethyl 2-bromo-3-methylbutanoate
Clé InChI WNFUWONOILPKNX-UHFFFAOYSA-N
SMILES CCOC(=O)C(C(C)C)Br
Formule moléculaire C7H13BrO2
10

Ethyl 2-fluoroisobutyrate, 97%, Thermo Scientific Chemicals

CAS: 55816-69-8 Formule moléculaire: C6H11FO2 Poids moléculaire (g/mol): 134.15 Numéro MDL: MFCD08062432 Clé InChI: CJRQQJKWNULSFQ-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 10898763 Nom IUPAC: ethyl 2-fluoro-2-methylpropanoate SMILES: CCOC(=O)C(C)(C)F

Poids moléculaire (g/mol) 134.15
Synonyme 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
Numéro MDL MFCD08062432
CAS 55816-69-8
CID PubChem 10898763
Nom IUPAC ethyl 2-fluoro-2-methylpropanoate
Clé InChI CJRQQJKWNULSFQ-UHFFFAOYSA-N
SMILES CCOC(=O)C(C)(C)F
Formule moléculaire C6H11FO2
11

Ethyl bromofluoroacetate, 97%

CAS: 401-55-8 Formule moléculaire: C4H6BrFO2 Poids moléculaire (g/mol): 184.992 Numéro MDL: MFCD00042095 Clé InChI: ULNDTPIRBQGESN-UHFFFAOYSA-N Synonyme: ethyl bromofluoroacetate,bromofluoroacetic acid ethyl ester,ethyl-2-bromofluoroacetate,ethylbromofluoroacetate,acetic acid, bromofluoro-, ethyl ester,bromofluoroacetate,ethyl fluorobromoacetate,acmc-209jb9,ksc236i3t CID PubChem: 2733407 Nom IUPAC: ethyl 2-bromo-2-fluoroacetate SMILES: CCOC(=O)C(F)Br

Poids moléculaire (g/mol) 184.992
Synonyme ethyl bromofluoroacetate,bromofluoroacetic acid ethyl ester,ethyl-2-bromofluoroacetate,ethylbromofluoroacetate,acetic acid, bromofluoro-, ethyl ester,bromofluoroacetate,ethyl fluorobromoacetate,acmc-209jb9,ksc236i3t
Numéro MDL MFCD00042095
CAS 401-55-8
CID PubChem 2733407
Nom IUPAC ethyl 2-bromo-2-fluoroacetate
Clé InChI ULNDTPIRBQGESN-UHFFFAOYSA-N
SMILES CCOC(=O)C(F)Br
Formule moléculaire C4H6BrFO2
12

Ethyl trifluoroacetate, 99%

CAS: 383-63-1 Formule moléculaire: C4H5F3O2 Poids moléculaire (g/mol): 142.077 Numéro MDL: MFCD00000419 Clé InChI: STSCVKRWJPWALQ-UHFFFAOYSA-N Synonyme: ethyl trifluoroacetate,trifluoroacetic acid ethyl ester,ethyltrifluoroacetate,acetic acid, trifluoro-, ethyl ester,trifluoroacetic acid, ethyl ester,ethyl trifluoroethanoate,unii-a6tzk6x11x,acetic acid, 2,2,2-trifluoro-, ethyl ester,a6tzk6x11x,ethyl ester of trifluoroacetic acid CID PubChem: 9794 Nom IUPAC: ethyl 2,2,2-trifluoroacetate SMILES: CCOC(=O)C(F)(F)F

Poids moléculaire (g/mol) 142.077
Synonyme ethyl trifluoroacetate,trifluoroacetic acid ethyl ester,ethyltrifluoroacetate,acetic acid, trifluoro-, ethyl ester,trifluoroacetic acid, ethyl ester,ethyl trifluoroethanoate,unii-a6tzk6x11x,acetic acid, 2,2,2-trifluoro-, ethyl ester,a6tzk6x11x,ethyl ester of trifluoroacetic acid
Numéro MDL MFCD00000419
CAS 383-63-1
CID PubChem 9794
Nom IUPAC ethyl 2,2,2-trifluoroacetate
Clé InChI STSCVKRWJPWALQ-UHFFFAOYSA-N
SMILES CCOC(=O)C(F)(F)F
Formule moléculaire C4H5F3O2
13

Chloroacetic acid sodium salt, 98%

CAS: 3926-62-3 Formule moléculaire: C2H2ClNaO2 Poids moléculaire (g/mol): 116.48 Numéro MDL: MFCD00002684 Clé InChI: FDRCDNZGSXJAFP-UHFFFAOYSA-M Synonyme: sodium chloroacetate,chloroacetic acid sodium salt,monoxone,acetic acid, chloro-, sodium salt,dow defoliant,sodium monochloroacetate,smca,sodium monochloracetate,caswell no. 755a,chloroctan sodny czech CID PubChem: 23665759 Nom IUPAC: sodium;2-chloroacetate SMILES: C(C(=O)[O-])Cl.[Na+]

Poids moléculaire (g/mol) 116.48
Synonyme sodium chloroacetate,chloroacetic acid sodium salt,monoxone,acetic acid, chloro-, sodium salt,dow defoliant,sodium monochloroacetate,smca,sodium monochloracetate,caswell no. 755a,chloroctan sodny czech
Numéro MDL MFCD00002684
CAS 3926-62-3
CID PubChem 23665759
Nom IUPAC sodium;2-chloroacetate
Clé InChI FDRCDNZGSXJAFP-UHFFFAOYSA-M
SMILES C(C(=O)[O-])Cl.[Na+]
Formule moléculaire C2H2ClNaO2
14

Chloroacetic anhydride, 97%

CAS: 541-88-8 Formule moléculaire: C4H4Cl2O3 Poids moléculaire (g/mol): 170.97 Numéro MDL: MFCD00000929 Clé InChI: PNVPNXKRAUBJGW-UHFFFAOYSA-N Synonyme: chloroacetic anhydride,chloracetic anhydride,monochloroacetic acid anhydride,2-chloroacetic anhydride,chloroacetic acid anhydride,chloroacetyl anhydride,acetic acid, chloro-, anhydride,unii-8q7txh7r5f,monochloroacetic anhydride,8q7txh7r5f CID PubChem: 10946 Nom IUPAC: (2-chloroacetyl) 2-chloroacetate SMILES: ClCC(=O)OC(=O)CCl

Poids moléculaire (g/mol) 170.97
Synonyme chloroacetic anhydride,chloracetic anhydride,monochloroacetic acid anhydride,2-chloroacetic anhydride,chloroacetic acid anhydride,chloroacetyl anhydride,acetic acid, chloro-, anhydride,unii-8q7txh7r5f,monochloroacetic anhydride,8q7txh7r5f
Numéro MDL MFCD00000929
CAS 541-88-8
CID PubChem 10946
Nom IUPAC (2-chloroacetyl) 2-chloroacetate
Clé InChI PNVPNXKRAUBJGW-UHFFFAOYSA-N
SMILES ClCC(=O)OC(=O)CCl
Formule moléculaire C4H4Cl2O3
15

Ethyl oxalyl chloride, 98%

CAS: 4755-77-5 Formule moléculaire: C4H5ClO3 Poids moléculaire (g/mol): 136.531 Numéro MDL: MFCD00000706 Clé InChI: OWZFULPEVHKEKS-UHFFFAOYSA-N Synonyme: ethyl chlorooxoacetate,ethyl oxalyl chloride,ethyl chloroglyoxylate,ethoxalyl chloride,ethyl oxalyl monochloride,acetic acid, chlorooxo-, ethyl ester,oxalic acid monoethyl ester chloride,monoethyl oxaloyl chloride,oxalyl chloride, ethyl ester,ethyl chlorocarbonyl formate CID PubChem: 20884 Nom IUPAC: ethyl 2-chloro-2-oxoacetate SMILES: CCOC(=O)C(=O)Cl

Poids moléculaire (g/mol) 136.531
Synonyme ethyl chlorooxoacetate,ethyl oxalyl chloride,ethyl chloroglyoxylate,ethoxalyl chloride,ethyl oxalyl monochloride,acetic acid, chlorooxo-, ethyl ester,oxalic acid monoethyl ester chloride,monoethyl oxaloyl chloride,oxalyl chloride, ethyl ester,ethyl chlorocarbonyl formate
Numéro MDL MFCD00000706
CAS 4755-77-5
CID PubChem 20884
Nom IUPAC ethyl 2-chloro-2-oxoacetate
Clé InChI OWZFULPEVHKEKS-UHFFFAOYSA-N
SMILES CCOC(=O)C(=O)Cl
Formule moléculaire C4H5ClO3