Organic acids and derivatives
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Dimethyl bromomalonate, 90%, tech.
CAS: 868-26-8 Molecular Formula: C5H7BrO4 Molecular Weight (g/mol): 211.02 MDL Number: MFCD00025865 InChI Key: NEMOJKROKMMQBQ-UHFFFAOYSA-N Synonym: dimethyl bromomalonate,dimethyl 2-bromomalonate,dimethylbromomalonate,propanedioic acid, bromo-, dimethyl ester,2-bromo dimethyl malonate,1,3-dimethyl 2-bromopropanedioate,dimethylbromomalo-nate,acmc-209qbk,dimethyl-2-bromomalonate,dimethyl 2-bromomalonate # PubChem CID: 70087 IUPAC Name: dimethyl 2-bromopropanedioate SMILES: COC(=O)C(C(=O)OC)Br
| PubChem CID | 70087 |
|---|---|
| CAS | 868-26-8 |
| Molecular Weight (g/mol) | 211.02 |
| MDL Number | MFCD00025865 |
| SMILES | COC(=O)C(C(=O)OC)Br |
| Synonym | dimethyl bromomalonate,dimethyl 2-bromomalonate,dimethylbromomalonate,propanedioic acid, bromo-, dimethyl ester,2-bromo dimethyl malonate,1,3-dimethyl 2-bromopropanedioate,dimethylbromomalo-nate,acmc-209qbk,dimethyl-2-bromomalonate,dimethyl 2-bromomalonate # |
| IUPAC Name | dimethyl 2-bromopropanedioate |
| InChI Key | NEMOJKROKMMQBQ-UHFFFAOYSA-N |
| Molecular Formula | C5H7BrO4 |
tert-Butyl chloroacetate, 98%
CAS: 107-59-5 Molecular Formula: C6H11ClO2 Molecular Weight (g/mol): 150.602 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) | 150.602 |
| 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 |
Ethyl 2,3-dibromopropionate, 97%
CAS: 3674-13-3 Molecular Formula: C5H8Br2O2 Molecular Weight (g/mol): 259.925 MDL Number: MFCD00000212 InChI Key: OENICUBCLXKLJQ-UHFFFAOYSA-N PubChem CID: 97945 IUPAC Name: ethyl 2,3-dibromopropanoate SMILES: CCOC(=O)C(CBr)Br
| PubChem CID | 97945 |
|---|---|
| CAS | 3674-13-3 |
| Molecular Weight (g/mol) | 259.925 |
| MDL Number | MFCD00000212 |
| SMILES | CCOC(=O)C(CBr)Br |
| IUPAC Name | ethyl 2,3-dibromopropanoate |
| InChI Key | OENICUBCLXKLJQ-UHFFFAOYSA-N |
| Molecular Formula | C5H8Br2O2 |
Ethyl 2-bromoisobutyrate, 98%
CAS: 600-00-0 Molecular Formula: C6H11BrO2 Molecular Weight (g/mol): 195.06 MDL Number: MFCD00000123 InChI Key: IOLQWGVDEFWYNP-UHFFFAOYSA-N Synonym: 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 PubChem CID: 11745 IUPAC Name: ethyl 2-bromo-2-methylpropanoate SMILES: CCOC(=O)C(C)(C)Br
| PubChem CID | 11745 |
|---|---|
| CAS | 600-00-0 |
| Molecular Weight (g/mol) | 195.06 |
| MDL Number | MFCD00000123 |
| SMILES | CCOC(=O)C(C)(C)Br |
| Synonym | 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 |
| IUPAC Name | ethyl 2-bromo-2-methylpropanoate |
| InChI Key | IOLQWGVDEFWYNP-UHFFFAOYSA-N |
| Molecular Formula | C6H11BrO2 |
Ammonium trifluoroacetate, 98%
CAS: 3336-58-1 Molecular Formula: C2H5F3NO2 Molecular Weight (g/mol): 132.06 MDL Number: MFCD00012615,MFCD03095537 InChI Key: YCNIBOIOWCTRCL-UHFFFAOYSA-O Synonym: ammonium trifluoroacetate,azanium 2,2,2-trifluoroacetate,ammoniumtrifluoroacetate,ammonium triflouroacetate,cf3coonh4,acmc-1cq68,2,2,2-trifluoroacetic acid, azamethane,acetic acid, trifluoro-, ammonium salt 8ci 9ci PubChem CID: 86601334 IUPAC Name: azanium;2,2,2-trifluoroacetic acid SMILES: [NH4+].OC(=O)C(F)(F)F
| PubChem CID | 86601334 |
|---|---|
| CAS | 3336-58-1 |
| Molecular Weight (g/mol) | 132.06 |
| MDL Number | MFCD00012615,MFCD03095537 |
| SMILES | [NH4+].OC(=O)C(F)(F)F |
| Synonym | ammonium trifluoroacetate,azanium 2,2,2-trifluoroacetate,ammoniumtrifluoroacetate,ammonium triflouroacetate,cf3coonh4,acmc-1cq68,2,2,2-trifluoroacetic acid, azamethane,acetic acid, trifluoro-, ammonium salt 8ci 9ci |
| IUPAC Name | azanium;2,2,2-trifluoroacetic acid |
| InChI Key | YCNIBOIOWCTRCL-UHFFFAOYSA-O |
| Molecular Formula | C2H5F3NO2 |
Mercury(II) trifluoroacetate, 98+%
CAS: 13257-51-7 Molecular Formula: C4F6HgO4 Molecular Weight (g/mol): 426.622 MDL Number: MFCD00013201 InChI Key: WMHOESUUCMEQMS-UHFFFAOYSA-L Synonym: mercury ii trifluoroacetate,mercury bis trifluoroacetate,mercury 2+ ditrifluoroacetate,mercury 2+ ; 2,2,2-trifluoroacetate,bis trifluoroacetato mercury,hg ococf3 2,hg o2ccf3 2,mercury bis-trifluoroacetate,mercury ii bis trifluoroacetate PubChem CID: 2723924 IUPAC Name: mercury(2+);2,2,2-trifluoroacetate SMILES: C(=O)(C(F)(F)F)[O-].C(=O)(C(F)(F)F)[O-].[Hg+2]
| PubChem CID | 2723924 |
|---|---|
| CAS | 13257-51-7 |
| Molecular Weight (g/mol) | 426.622 |
| MDL Number | MFCD00013201 |
| SMILES | C(=O)(C(F)(F)F)[O-].C(=O)(C(F)(F)F)[O-].[Hg+2] |
| Synonym | mercury ii trifluoroacetate,mercury bis trifluoroacetate,mercury 2+ ditrifluoroacetate,mercury 2+ ; 2,2,2-trifluoroacetate,bis trifluoroacetato mercury,hg ococf3 2,hg o2ccf3 2,mercury bis-trifluoroacetate,mercury ii bis trifluoroacetate |
| IUPAC Name | mercury(2+);2,2,2-trifluoroacetate |
| InChI Key | WMHOESUUCMEQMS-UHFFFAOYSA-L |
| Molecular Formula | C4F6HgO4 |
(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 |
Lithium trifluoroacetate, 97%
CAS: 2923-17-3 Molecular Formula: C2F3LiO2 Molecular Weight (g/mol): 119.96 MDL Number: MFCD00013216,MFCD00149663 InChI Key: HSFDLPWPRRSVSM-UHFFFAOYSA-M Synonym: lithium trifluoroacetate,acetic acid, trifluoro-, lithium salt,lithium 2,2,2-trifluoroacetate,lithiumtrifluoroacetate,acmc-1cfal,lithotab trifluoroacetate,acetic acid, 2,2,2-trifluoro-, lithium salt 1:1,lithium trifluoroacetate, monohydrate,lithium 1+ trifluoroacetate,lithio 2,2,2-trifluoroacetate PubChem CID: 23661853 IUPAC Name: lithium;2,2,2-trifluoroacetate SMILES: [Li+].[O-]C(=O)C(F)(F)F
| PubChem CID | 23661853 |
|---|---|
| CAS | 2923-17-3 |
| Molecular Weight (g/mol) | 119.96 |
| MDL Number | MFCD00013216,MFCD00149663 |
| SMILES | [Li+].[O-]C(=O)C(F)(F)F |
| Synonym | lithium trifluoroacetate,acetic acid, trifluoro-, lithium salt,lithium 2,2,2-trifluoroacetate,lithiumtrifluoroacetate,acmc-1cfal,lithotab trifluoroacetate,acetic acid, 2,2,2-trifluoro-, lithium salt 1:1,lithium trifluoroacetate, monohydrate,lithium 1+ trifluoroacetate,lithio 2,2,2-trifluoroacetate |
| IUPAC Name | lithium;2,2,2-trifluoroacetate |
| InChI Key | HSFDLPWPRRSVSM-UHFFFAOYSA-M |
| Molecular Formula | C2F3LiO2 |
Ethyl 2,2-difluoropropionate, 97%
CAS: 28781-85-3 Molecular Formula: C5H8F2O2 Molecular Weight (g/mol): 138.114 MDL Number: MFCD06657970 InChI Key: ISVLDAIKRGXNCZ-UHFFFAOYSA-N Synonym: 2,2-difluoropropionic acid ethyl ester,ethyl 2,2-difluoropropionate,2,2-difluoropropionicacidethylester,2,2-difluoro-propionic acid ethyl ester,propanoic acid, 2,2-difluoro-, ethyl ester,ethyl difluoropropionate,ethyl 2,2 difluoropropionate,difluoropropionic acid ethyl ester,2,2-difluoropropionic acidethyl ester PubChem CID: 2761188 IUPAC Name: ethyl 2,2-difluoropropanoate SMILES: CCOC(=O)C(C)(F)F
| PubChem CID | 2761188 |
|---|---|
| CAS | 28781-85-3 |
| Molecular Weight (g/mol) | 138.114 |
| MDL Number | MFCD06657970 |
| SMILES | CCOC(=O)C(C)(F)F |
| Synonym | 2,2-difluoropropionic acid ethyl ester,ethyl 2,2-difluoropropionate,2,2-difluoropropionicacidethylester,2,2-difluoro-propionic acid ethyl ester,propanoic acid, 2,2-difluoro-, ethyl ester,ethyl difluoropropionate,ethyl 2,2 difluoropropionate,difluoropropionic acid ethyl ester,2,2-difluoropropionic acidethyl ester |
| IUPAC Name | ethyl 2,2-difluoropropanoate |
| InChI Key | ISVLDAIKRGXNCZ-UHFFFAOYSA-N |
| Molecular Formula | C5H8F2O2 |
Diethyl bromomalonate, 90+%
CAS: 685-87-0 Molecular Formula: C7H11BrO4 Molecular Weight (g/mol): 239.065 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
| PubChem CID | 69637 |
|---|---|
| CAS | 685-87-0 |
| Molecular Weight (g/mol) | 239.065 |
| 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 |
Ethyl fluoroacetate, 97%, Thermo Scientific Chemicals
CAS: 459-72-3 Molecular Formula: C4H7FO2 Molecular Weight (g/mol): 106.1 MDL Number: MFCD00000450 InChI Key: VCYZVXRKYPKDQB-UHFFFAOYSA-N Synonym: ethyl fluoroacetate,ethyl monofluoroacetate,acetic acid, fluoro-, ethyl ester,fluoroacetic acid ethyl ester,unii-aus1l6um7b,ethylester kyseliny fluoroctove,monofluoroacetic acid ethyl ester,aus1l6um7b,ethylester kyseliny fluoroctove czech,acetic acid, 2-fluoro-, ethyl ester PubChem CID: 9988 IUPAC Name: ethyl 2-fluoroacetate SMILES: CCOC(=O)CF
| PubChem CID | 9988 |
|---|---|
| CAS | 459-72-3 |
| Molecular Weight (g/mol) | 106.1 |
| MDL Number | MFCD00000450 |
| SMILES | CCOC(=O)CF |
| Synonym | ethyl fluoroacetate,ethyl monofluoroacetate,acetic acid, fluoro-, ethyl ester,fluoroacetic acid ethyl ester,unii-aus1l6um7b,ethylester kyseliny fluoroctove,monofluoroacetic acid ethyl ester,aus1l6um7b,ethylester kyseliny fluoroctove czech,acetic acid, 2-fluoro-, ethyl ester |
| IUPAC Name | ethyl 2-fluoroacetate |
| InChI Key | VCYZVXRKYPKDQB-UHFFFAOYSA-N |
| Molecular Formula | C4H7FO2 |
Trichloroacetic anhydride, 95%
CAS: 4124-31-6 Molecular Formula: C4Cl6O3 Molecular Weight (g/mol): 308.741 MDL Number: MFCD00000793 InChI Key: MEFKFJOEVLUFAY-UHFFFAOYSA-N Synonym: trichloroacetic anhydride,acetic acid, trichloro-, anhydride,acetic acid, 2,2,2-trichloro-, 1,1'-anhydride,acmc-1aliy,perchloroacetic anhydride,bis trichloroacetic anhydride,trichloroacetic acid anhydride,2,2,2-trichloroacetic anhydride,trichloroacetyl 2,2,2-trichloroacetate PubChem CID: 20079 IUPAC Name: (2,2,2-trichloroacetyl) 2,2,2-trichloroacetate SMILES: C(=O)(C(Cl)(Cl)Cl)OC(=O)C(Cl)(Cl)Cl
| PubChem CID | 20079 |
|---|---|
| CAS | 4124-31-6 |
| Molecular Weight (g/mol) | 308.741 |
| MDL Number | MFCD00000793 |
| SMILES | C(=O)(C(Cl)(Cl)Cl)OC(=O)C(Cl)(Cl)Cl |
| Synonym | trichloroacetic anhydride,acetic acid, trichloro-, anhydride,acetic acid, 2,2,2-trichloro-, 1,1'-anhydride,acmc-1aliy,perchloroacetic anhydride,bis trichloroacetic anhydride,trichloroacetic acid anhydride,2,2,2-trichloroacetic anhydride,trichloroacetyl 2,2,2-trichloroacetate |
| IUPAC Name | (2,2,2-trichloroacetyl) 2,2,2-trichloroacetate |
| InChI Key | MEFKFJOEVLUFAY-UHFFFAOYSA-N |
| Molecular Formula | C4Cl6O3 |
Ethyl 2-bromo-3-methylbutyrate, 95%
CAS: 609-12-1 Molecular Formula: C7H13BrO2 Molecular Weight (g/mol): 209.08 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
| PubChem CID | 79068 |
|---|---|
| CAS | 609-12-1 |
| Molecular Weight (g/mol) | 209.08 |
| 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 |
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 |
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 |