Organic acids and derivatives
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5-Bromo-4-chloro-3-indolyl phosphate disodium salt, 98+%, Thermo Scientific Chemicals
CAS: 102185-33-1 Molecular Formula: C8H4BrClNNa2O4P Molecular Weight (g/mol): 370.43 MDL Number: MFCD00036757 InChI Key: OAZUOCJOEUNDEK-UHFFFAOYSA-L PubChem CID: 6097197 IUPAC Name: disodium;(5-bromo-4-chloro-1H-indol-3-yl) phosphate SMILES: [Na+].[Na+].[O-]P([O-])(=O)OC1=CNC2=CC=C(Br)C(Cl)=C12
| PubChem CID | 6097197 |
|---|---|
| CAS | 102185-33-1 |
| Molecular Weight (g/mol) | 370.43 |
| MDL Number | MFCD00036757 |
| SMILES | [Na+].[Na+].[O-]P([O-])(=O)OC1=CNC2=CC=C(Br)C(Cl)=C12 |
| IUPAC Name | disodium;(5-bromo-4-chloro-1H-indol-3-yl) phosphate |
| InChI Key | OAZUOCJOEUNDEK-UHFFFAOYSA-L |
| Molecular Formula | C8H4BrClNNa2O4P |
Guanosine-5'-monophosphate, Free acid, ≥98%, MP Biomedicals™
CAS: 85-32-5 Molecular Formula: C10H14N5O8P Molecular Weight (g/mol): 363.223 InChI Key: RQFCJASXJCIDSX-UUOKFMHZSA-N Synonym: 5'-guanylic acid,guanosine monophosphate,guanylic acid,guanosine-5'-monophosphate,guanosine 5'-monophosphate,5'-gmp,guanosine 5'-phosphate,guanylate,guanidine monophosphate,guanosine-phosphate PubChem CID: 6804 ChEBI: CHEBI:17345 IUPAC Name: [(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate SMILES: C1=NC2=C(N1C3C(C(C(O3)COP(=O)(O)O)O)O)NC(=NC2=O)N
| PubChem CID | 6804 |
|---|---|
| CAS | 85-32-5 |
| Molecular Weight (g/mol) | 363.223 |
| ChEBI | CHEBI:17345 |
| SMILES | C1=NC2=C(N1C3C(C(C(O3)COP(=O)(O)O)O)O)NC(=NC2=O)N |
| Synonym | 5'-guanylic acid,guanosine monophosphate,guanylic acid,guanosine-5'-monophosphate,guanosine 5'-monophosphate,5'-gmp,guanosine 5'-phosphate,guanylate,guanidine monophosphate,guanosine-phosphate |
| IUPAC Name | [(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate |
| InChI Key | RQFCJASXJCIDSX-UUOKFMHZSA-N |
| Molecular Formula | C10H14N5O8P |
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 |
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 |
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 |
DL-Ethyl 2-bromovalerate, 99%, Thermo Scientific™
CAS: 615-83-8 Molecular Formula: C7H13BrO2 Molecular Weight (g/mol): 209.08 MDL Number: MFCD00000159 InChI Key: ORSIRXYHFPHWTN-UHFFFAOYSA-N PubChem CID: 79071 IUPAC Name: ethyl 2-bromopentanoate SMILES: CCCC(C(=O)OCC)Br
| PubChem CID | 79071 |
|---|---|
| CAS | 615-83-8 |
| Molecular Weight (g/mol) | 209.08 |
| MDL Number | MFCD00000159 |
| SMILES | CCCC(C(=O)OCC)Br |
| IUPAC Name | ethyl 2-bromopentanoate |
| InChI Key | ORSIRXYHFPHWTN-UHFFFAOYSA-N |
| Molecular Formula | C7H13BrO2 |
Ethyl 2-bromo-4,4,4-trifluorobutyrate, 97%
CAS: 367-33-9 Molecular Formula: C6H8BrF3O2 Molecular Weight (g/mol): 249.027 MDL Number: MFCD10687235 InChI Key: POVYUFTVLGOXEE-UHFFFAOYSA-N Synonym: 2-bromo-4,4,4-trifluorobutyric acid ethyl ester,ethyl 2-bromo-4,4,4-trifluorobutyrate,ethyl 2-bromo-4,4,4-trifluoro-butanoate,butanoic acid,2-bromo-4,4,4-trifluoro-, ethyl ester PubChem CID: 45594306 IUPAC Name: ethyl 2-bromo-4,4,4-trifluorobutanoate SMILES: CCOC(=O)C(CC(F)(F)F)Br
| PubChem CID | 45594306 |
|---|---|
| CAS | 367-33-9 |
| Molecular Weight (g/mol) | 249.027 |
| MDL Number | MFCD10687235 |
| SMILES | CCOC(=O)C(CC(F)(F)F)Br |
| Synonym | 2-bromo-4,4,4-trifluorobutyric acid ethyl ester,ethyl 2-bromo-4,4,4-trifluorobutyrate,ethyl 2-bromo-4,4,4-trifluoro-butanoate,butanoic acid,2-bromo-4,4,4-trifluoro-, ethyl ester |
| IUPAC Name | ethyl 2-bromo-4,4,4-trifluorobutanoate |
| InChI Key | POVYUFTVLGOXEE-UHFFFAOYSA-N |
| Molecular Formula | C6H8BrF3O2 |
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
| 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 |
Diisopropyl methylphosphonate, 90%, Thermo Scientific Chemicals
CAS: 1445-75-6 Molecular Formula: C7H17O3P Molecular Weight (g/mol): 180.18 MDL Number: MFCD00015022 InChI Key: WOAFDHWYKSOANX-UHFFFAOYSA-N Synonym: diisopropyl methylphosphonate,diisopropyl methanephosphonate,bis 1-methylethyl methylphosphonate,unii-56v3og5dc7,methylphosphonic acid diisopropyl ester,phosphonic acid, methyl-, bis 1-methylethyl ester,phosphonic acid, methyl-, diisopropyl ester,methylphosphonic acid bis 1-methylethyl ester,dsstox_cid_4051,dsstox_rid_77269 PubChem CID: 3073 ChEBI: CHEBI:77325 IUPAC Name: 2-[methyl(propan-2-yloxy)phosphoryl]oxypropane SMILES: CC(C)OP(C)(=O)OC(C)C
| PubChem CID | 3073 |
|---|---|
| CAS | 1445-75-6 |
| Molecular Weight (g/mol) | 180.18 |
| ChEBI | CHEBI:77325 |
| MDL Number | MFCD00015022 |
| SMILES | CC(C)OP(C)(=O)OC(C)C |
| Synonym | diisopropyl methylphosphonate,diisopropyl methanephosphonate,bis 1-methylethyl methylphosphonate,unii-56v3og5dc7,methylphosphonic acid diisopropyl ester,phosphonic acid, methyl-, bis 1-methylethyl ester,phosphonic acid, methyl-, diisopropyl ester,methylphosphonic acid bis 1-methylethyl ester,dsstox_cid_4051,dsstox_rid_77269 |
| IUPAC Name | 2-[methyl(propan-2-yloxy)phosphoryl]oxypropane |
| InChI Key | WOAFDHWYKSOANX-UHFFFAOYSA-N |
| Molecular Formula | C7H17O3P |
1,2-Bis(dimethoxyphosphoryl)benzene, 99%
CAS: 15104-46-8 Molecular Formula: C10H16O6P2 Molecular Weight (g/mol): 294.18 MDL Number: MFCD00142461 InChI Key: TUKTVDDATWNXSN-UHFFFAOYSA-N Synonym: 1,2-bis dimethoxyphosphoryl benzene,tetramethyl 1,2-phenylenebis phosphonate,tetramethyl-1,2-phenylenediphosphonate,dimethyl 2-dimethoxyphosphoryl phenylphosphonate,acmc-20ap6x,bis dimethoxyphosphoryl benzene,1,2-bis dimethoxyphosphinyl benzene,1,2-bis dimethoxyphosphoryl benzene 500mg,2-dimethoxycarbonyl phenyl dimethoxyphosphino-1-one PubChem CID: 2733153 IUPAC Name: 1,2-bis(dimethoxyphosphoryl)benzene SMILES: COP(=O)(C1=CC=CC=C1P(=O)(OC)OC)OC
| PubChem CID | 2733153 |
|---|---|
| CAS | 15104-46-8 |
| Molecular Weight (g/mol) | 294.18 |
| MDL Number | MFCD00142461 |
| SMILES | COP(=O)(C1=CC=CC=C1P(=O)(OC)OC)OC |
| Synonym | 1,2-bis dimethoxyphosphoryl benzene,tetramethyl 1,2-phenylenebis phosphonate,tetramethyl-1,2-phenylenediphosphonate,dimethyl 2-dimethoxyphosphoryl phenylphosphonate,acmc-20ap6x,bis dimethoxyphosphoryl benzene,1,2-bis dimethoxyphosphinyl benzene,1,2-bis dimethoxyphosphoryl benzene 500mg,2-dimethoxycarbonyl phenyl dimethoxyphosphino-1-one |
| IUPAC Name | 1,2-bis(dimethoxyphosphoryl)benzene |
| InChI Key | TUKTVDDATWNXSN-UHFFFAOYSA-N |
| Molecular Formula | C10H16O6P2 |
Triethyl 4-phosphonobutyrate, 97%
CAS: 2327-69-7 Molecular Formula: C10H21O5P Molecular Weight (g/mol): 252.247 MDL Number: MFCD00015168 InChI Key: FYESTJSRASJZOY-UHFFFAOYSA-N PubChem CID: 281201 IUPAC Name: ethyl 4-diethoxyphosphorylbutanoate SMILES: CCOC(=O)CCCP(=O)(OCC)OCC
| PubChem CID | 281201 |
|---|---|
| CAS | 2327-69-7 |
| Molecular Weight (g/mol) | 252.247 |
| MDL Number | MFCD00015168 |
| SMILES | CCOC(=O)CCCP(=O)(OCC)OCC |
| IUPAC Name | ethyl 4-diethoxyphosphorylbutanoate |
| InChI Key | FYESTJSRASJZOY-UHFFFAOYSA-N |
| Molecular Formula | C10H21O5P |
tert-Butylphosphonic acid, 98%
CAS: 4923-84-6 Molecular Formula: C4H9O3P Molecular Weight (g/mol): 136.09 MDL Number: MFCD00012296 InChI Key: OGDSVONAYZTTDA-UHFFFAOYSA-L Synonym: phosphonic acid, 1,1-dimethylethyl,acmc-20ajka,t-butylphosphonic acid,tert-butylphosphonic acid,2-methylprop-2-ylphosphonic acid,phosphonicacid, 1,1-dimethylethyl PubChem CID: 312546 IUPAC Name: tert-butylphosphonic acid SMILES: CC(C)(C)P([O-])([O-])=O
| PubChem CID | 312546 |
|---|---|
| CAS | 4923-84-6 |
| Molecular Weight (g/mol) | 136.09 |
| MDL Number | MFCD00012296 |
| SMILES | CC(C)(C)P([O-])([O-])=O |
| Synonym | phosphonic acid, 1,1-dimethylethyl,acmc-20ajka,t-butylphosphonic acid,tert-butylphosphonic acid,2-methylprop-2-ylphosphonic acid,phosphonicacid, 1,1-dimethylethyl |
| IUPAC Name | tert-butylphosphonic acid |
| InChI Key | OGDSVONAYZTTDA-UHFFFAOYSA-L |
| Molecular Formula | C4H9O3P |
12-Mercaptododecylphosphonic acid, 95%
CAS: 159239-33-5 Molecular Formula: C12H27O3PS Molecular Weight (g/mol): 282.38 MDL Number: MFCD11046116 InChI Key: PVIUMTORLYKRJT-UHFFFAOYSA-N Synonym: 12-mercaptododecylphosphonic acid,12-sulfanyldodecyl phosphonic acid PubChem CID: 45158994 IUPAC Name: 12-sulfanyldodecylphosphonic acid SMILES: OP(O)(=O)CCCCCCCCCCCCS
| PubChem CID | 45158994 |
|---|---|
| CAS | 159239-33-5 |
| Molecular Weight (g/mol) | 282.38 |
| MDL Number | MFCD11046116 |
| SMILES | OP(O)(=O)CCCCCCCCCCCCS |
| Synonym | 12-mercaptododecylphosphonic acid,12-sulfanyldodecyl phosphonic acid |
| IUPAC Name | 12-sulfanyldodecylphosphonic acid |
| InChI Key | PVIUMTORLYKRJT-UHFFFAOYSA-N |
| Molecular Formula | C12H27O3PS |
Diethyl 2,2-diethoxyethylphosphonate, 96%
CAS: 7598-61-0 Molecular Formula: C10H23O5P Molecular Weight (g/mol): 254.263 MDL Number: MFCD00009236 InChI Key: LUQYELQXRPNKRY-UHFFFAOYSA-N Synonym: diethyl 2,2-diethoxyethylphosphonate,diethyl 2,2-diethoxyethyl phosphonate,diethyl2,2-diethoxyethylphosphonate,2,2-diethoxyethylphosphonic acid diethyl ester,phosphonic acid, 2,2-diethoxyethyl-, diethyl ester,2,2-diethoxyethyl diethoxyphosphino-1-one,diethyl phosphonacetaldehyde diethyl acetal,diethylphosphonoacetaldehyde diethylacetal,2-diethoxyphosphoryl-1,1-diethoxy-ethane PubChem CID: 82071 IUPAC Name: 2-diethoxyphosphoryl-1,1-diethoxyethane SMILES: CCOC(CP(=O)(OCC)OCC)OCC
| PubChem CID | 82071 |
|---|---|
| CAS | 7598-61-0 |
| Molecular Weight (g/mol) | 254.263 |
| MDL Number | MFCD00009236 |
| SMILES | CCOC(CP(=O)(OCC)OCC)OCC |
| Synonym | diethyl 2,2-diethoxyethylphosphonate,diethyl 2,2-diethoxyethyl phosphonate,diethyl2,2-diethoxyethylphosphonate,2,2-diethoxyethylphosphonic acid diethyl ester,phosphonic acid, 2,2-diethoxyethyl-, diethyl ester,2,2-diethoxyethyl diethoxyphosphino-1-one,diethyl phosphonacetaldehyde diethyl acetal,diethylphosphonoacetaldehyde diethylacetal,2-diethoxyphosphoryl-1,1-diethoxy-ethane |
| IUPAC Name | 2-diethoxyphosphoryl-1,1-diethoxyethane |
| InChI Key | LUQYELQXRPNKRY-UHFFFAOYSA-N |
| Molecular Formula | C10H23O5P |