Organic acids and derivatives
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Tris(1,1,1,3,3,3-hexafluoro-2-propyl) Phosphate 98.0+%, TCI America™
CAS: 66489-68-7 Molecular Formula: C9H3F18O4P Molecular Weight (g/mol): 548.064 InChI Key: QLCATRCPAOPBOP-UHFFFAOYSA-N Synonym: Phosphoric Acid Tris(1,1,1,3,3,3-hexafluoro-2-propyl) Ester PubChem CID: 13681431 IUPAC Name: tris(1,1,1,3,3,3-hexafluoropropan-2-yl) phosphate SMILES: C(C(F)(F)F)(C(F)(F)F)OP(=O)(OC(C(F)(F)F)C(F)(F)F)OC(C(F)(F)F)C(F)(F)F
| PubChem CID | 13681431 |
|---|---|
| CAS | 66489-68-7 |
| Molecular Weight (g/mol) | 548.064 |
| SMILES | C(C(F)(F)F)(C(F)(F)F)OP(=O)(OC(C(F)(F)F)C(F)(F)F)OC(C(F)(F)F)C(F)(F)F |
| Synonym | Phosphoric Acid Tris(1,1,1,3,3,3-hexafluoro-2-propyl) Ester |
| IUPAC Name | tris(1,1,1,3,3,3-hexafluoropropan-2-yl) phosphate |
| InChI Key | QLCATRCPAOPBOP-UHFFFAOYSA-N |
| Molecular Formula | C9H3F18O4P |
Methyl Propiolate 98.0+%, TCI America™
CAS: 922-67-8 Molecular Formula: C4H4O2 Molecular Weight (g/mol): 84.074 MDL Number: MFCD00008572 InChI Key: IMAKHNTVDGLIRY-UHFFFAOYSA-N Synonym: methyl propiolate,methyl propynoate,2-propynoic acid, methyl ester,propiolic acid, methyl ester,methyl acetylenecarboxylate,methyl ethynecarboxylate,propynoic acid, methyl ester,propynoic acid methyl ester,methyl propargylate,acetylenecarboxylic acid methyl ester PubChem CID: 13536 IUPAC Name: methyl prop-2-ynoate SMILES: COC(=O)C#C
| PubChem CID | 13536 |
|---|---|
| CAS | 922-67-8 |
| Molecular Weight (g/mol) | 84.074 |
| MDL Number | MFCD00008572 |
| SMILES | COC(=O)C#C |
| Synonym | methyl propiolate,methyl propynoate,2-propynoic acid, methyl ester,propiolic acid, methyl ester,methyl acetylenecarboxylate,methyl ethynecarboxylate,propynoic acid, methyl ester,propynoic acid methyl ester,methyl propargylate,acetylenecarboxylic acid methyl ester |
| IUPAC Name | methyl prop-2-ynoate |
| InChI Key | IMAKHNTVDGLIRY-UHFFFAOYSA-N |
| Molecular Formula | C4H4O2 |
Methyl Phenylpropiolate 98.0+%, TCI America™
CAS: 4891-38-7 Molecular Formula: C10H8O2 Molecular Weight (g/mol): 160.172 MDL Number: MFCD00041685 InChI Key: JFGWPXKGINUNDH-UHFFFAOYSA-N Synonym: methyl phenylpropiolate,methyl 3-phenylpropiolate,phenylpropynoic acid methyl ester,2-propynoic acid, 3-phenyl-, methyl ester,methyl phenylpropargylate,phenylpropiolic acid methyl ester,propiolic acid, 3-phenyl-, methyl ester,methylphenylpropalate,propiolic acid, phenyl-, methyl ester,methyl phenylpropynoate PubChem CID: 138378 IUPAC Name: methyl 3-phenylprop-2-ynoate SMILES: COC(=O)C#CC1=CC=CC=C1
| PubChem CID | 138378 |
|---|---|
| CAS | 4891-38-7 |
| Molecular Weight (g/mol) | 160.172 |
| MDL Number | MFCD00041685 |
| SMILES | COC(=O)C#CC1=CC=CC=C1 |
| Synonym | methyl phenylpropiolate,methyl 3-phenylpropiolate,phenylpropynoic acid methyl ester,2-propynoic acid, 3-phenyl-, methyl ester,methyl phenylpropargylate,phenylpropiolic acid methyl ester,propiolic acid, 3-phenyl-, methyl ester,methylphenylpropalate,propiolic acid, phenyl-, methyl ester,methyl phenylpropynoate |
| IUPAC Name | methyl 3-phenylprop-2-ynoate |
| InChI Key | JFGWPXKGINUNDH-UHFFFAOYSA-N |
| Molecular Formula | C10H8O2 |
1,3-Phenylenediamine Sulfate 98.0+%, TCI America™
CAS: 541-70-8 Molecular Formula: C6H10N2O4S Molecular Weight (g/mol): 206.216 MDL Number: MFCD00060223 InChI Key: LDXYDHGRKFMULJ-UHFFFAOYSA-N Synonym: 1,3-Diaminobenzene Sulfate PubChem CID: 10942 IUPAC Name: benzene-1,3-diamine;sulfuric acid SMILES: C1=CC(=CC(=C1)N)N.OS(=O)(=O)O
| PubChem CID | 10942 |
|---|---|
| CAS | 541-70-8 |
| Molecular Weight (g/mol) | 206.216 |
| MDL Number | MFCD00060223 |
| SMILES | C1=CC(=CC(=C1)N)N.OS(=O)(=O)O |
| Synonym | 1,3-Diaminobenzene Sulfate |
| IUPAC Name | benzene-1,3-diamine;sulfuric acid |
| InChI Key | LDXYDHGRKFMULJ-UHFFFAOYSA-N |
| Molecular Formula | C6H10N2O4S |
Tetraethyl Ethylenediphosphonate 98.0+%, TCI America™
CAS: 995-32-4 Molecular Formula: C10H24O6P2 Molecular Weight (g/mol): 302.24 MDL Number: MFCD00015133 InChI Key: RSQYXXACEZCDFS-UHFFFAOYSA-N Synonym: tetraethyl ethylenediphosphonate,tetraethyl ethylenebisphosphonate,ethylenediphosphonic acid tetraethyl ester,tetraethyl ethane-1,2-diylbis phosphonate,1,2-bis diethoxyphosphoryl ethane,1,2-bis diethyl-phosphonato ethane,phosphonic acid, 1,2-ethanediylbis-, tetraethyl ester,diethyl 2-diethoxyphosphoryl ethylphosphonate,phosphonic acid, ethylenedi-, tetraethyl ester,acmc-209scy PubChem CID: 70446 IUPAC Name: diethyl [2-(diethoxyphosphoryl)ethyl]phosphonate SMILES: CCOP(=O)(CCP(=O)(OCC)OCC)OCC
| PubChem CID | 70446 |
|---|---|
| CAS | 995-32-4 |
| Molecular Weight (g/mol) | 302.24 |
| MDL Number | MFCD00015133 |
| SMILES | CCOP(=O)(CCP(=O)(OCC)OCC)OCC |
| Synonym | tetraethyl ethylenediphosphonate,tetraethyl ethylenebisphosphonate,ethylenediphosphonic acid tetraethyl ester,tetraethyl ethane-1,2-diylbis phosphonate,1,2-bis diethoxyphosphoryl ethane,1,2-bis diethyl-phosphonato ethane,phosphonic acid, 1,2-ethanediylbis-, tetraethyl ester,diethyl 2-diethoxyphosphoryl ethylphosphonate,phosphonic acid, ethylenedi-, tetraethyl ester,acmc-209scy |
| IUPAC Name | diethyl [2-(diethoxyphosphoryl)ethyl]phosphonate |
| InChI Key | RSQYXXACEZCDFS-UHFFFAOYSA-N |
| Molecular Formula | C10H24O6P2 |
Methyl 3-Methoxyphenylacetate 98.0+%, TCI America™
CAS: 18927-05-4 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00017205 InChI Key: BSVIOYCZTJRBDB-UHFFFAOYSA-N Synonym: methyl 2-3-methoxyphenyl acetate,methyl 3-methoxyphenylacetate,benzeneacetic acid, 3-methoxy-, methyl ester,acetic acid, m-methoxyphenyl-, methyl ester,methyl 3-methoxyphenyl acetate,3-methoxy-phenyl-acetic acid methyl ester,acmc-1brer,methyl m-methoxyphenylacetate,methyl 3-methoxy-phenylacetate PubChem CID: 519609 IUPAC Name: methyl 2-(3-methoxyphenyl)acetate SMILES: COC1=CC=CC(=C1)CC(=O)OC
| PubChem CID | 519609 |
|---|---|
| CAS | 18927-05-4 |
| Molecular Weight (g/mol) | 180.203 |
| MDL Number | MFCD00017205 |
| SMILES | COC1=CC=CC(=C1)CC(=O)OC |
| Synonym | methyl 2-3-methoxyphenyl acetate,methyl 3-methoxyphenylacetate,benzeneacetic acid, 3-methoxy-, methyl ester,acetic acid, m-methoxyphenyl-, methyl ester,methyl 3-methoxyphenyl acetate,3-methoxy-phenyl-acetic acid methyl ester,acmc-1brer,methyl m-methoxyphenylacetate,methyl 3-methoxy-phenylacetate |
| IUPAC Name | methyl 2-(3-methoxyphenyl)acetate |
| InChI Key | BSVIOYCZTJRBDB-UHFFFAOYSA-N |
| Molecular Formula | C10H12O3 |
Tetrakis(acetonitrile)palladium(II) Bis(trifluoromethanesulfonate) 95.0+%, TCI America™
CAS: 68569-14-2 Molecular Formula: C10H12F6N4O6PdS2 Molecular Weight (g/mol): 568.758 InChI Key: KXRMHIBEZBOSNG-UHFFFAOYSA-L Synonym: Tetrakis(acetonitrile)palladium(II) Ditriflate PubChem CID: 22755518 IUPAC Name: acetonitrile;palladium(2+);trifluoromethanesulfonate SMILES: CC#N.CC#N.CC#N.CC#N.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Pd+2]
| PubChem CID | 22755518 |
|---|---|
| CAS | 68569-14-2 |
| Molecular Weight (g/mol) | 568.758 |
| SMILES | CC#N.CC#N.CC#N.CC#N.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Pd+2] |
| Synonym | Tetrakis(acetonitrile)palladium(II) Ditriflate |
| IUPAC Name | acetonitrile;palladium(2+);trifluoromethanesulfonate |
| InChI Key | KXRMHIBEZBOSNG-UHFFFAOYSA-L |
| Molecular Formula | C10H12F6N4O6PdS2 |
Ethyl 2-Bromoisovalerate 98.0+%, TCI America™
CAS: 609-12-1 Molecular Formula: C7H13BrO2 Molecular Weight (g/mol): 209.083 MDL Number: MFCD00026855 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) | 209.083 |
| MDL Number | MFCD00026855 |
| 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 |
4-Ethylcyclohexanecarboxylic Acid (cis- and trans- mixture) 98.0+%, TCI America™
CAS: 91328-77-7 Molecular Formula: C9H16O2 Molecular Weight (g/mol): 156.23 MDL Number: MFCD01076323,MFCD01568857 InChI Key: UNROFSAOTBVBBT-UHFFFAOYSA-N Synonym: trans-4-ethylcyclohexanecarboxylic acid,4-ethylcyclohexanecarboxylic acid,cyclohexanecarboxylic acid, 4-ethyl,4-trans-ethyl cyclohexane carboxylic acid,cyclohexanecarboxylic acid, 4-ethyl-, trans,1s,4r-4-ethylcyclohexane-1-carboxylic acid,pubchem2491,acmc-209o2z,ksc352s1t,ksc352s2b PubChem CID: 1490288 IUPAC Name: 4-ethylcyclohexane-1-carboxylic acid SMILES: CCC1CCC(CC1)C(O)=O
| PubChem CID | 1490288 |
|---|---|
| CAS | 91328-77-7 |
| Molecular Weight (g/mol) | 156.23 |
| MDL Number | MFCD01076323,MFCD01568857 |
| SMILES | CCC1CCC(CC1)C(O)=O |
| Synonym | trans-4-ethylcyclohexanecarboxylic acid,4-ethylcyclohexanecarboxylic acid,cyclohexanecarboxylic acid, 4-ethyl,4-trans-ethyl cyclohexane carboxylic acid,cyclohexanecarboxylic acid, 4-ethyl-, trans,1s,4r-4-ethylcyclohexane-1-carboxylic acid,pubchem2491,acmc-209o2z,ksc352s1t,ksc352s2b |
| IUPAC Name | 4-ethylcyclohexane-1-carboxylic acid |
| InChI Key | UNROFSAOTBVBBT-UHFFFAOYSA-N |
| Molecular Formula | C9H16O2 |
3-(3-Pyridyl)propionic Acid 98.0+%, TCI America™
CAS: 3724-19-4 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.165 MDL Number: MFCD00274197 InChI Key: WDGXIUUWINKTGP-UHFFFAOYSA-N Synonym: 3-3-pyridyl propionic acid,3-pyridinepropionic acid,3-pyridinepropanoic acid,3-pyridin-3-yl propanoic acid,3-3-pyridyl propionicacid,pyridine-3-propionic acid,3-3-pyridyl propanoic acid,3-pyridin-3-yl propionic acid,pubchem8701,maybridge4_001332 PubChem CID: 259624 IUPAC Name: 3-pyridin-3-ylpropanoic acid SMILES: C1=CC(=CN=C1)CCC(=O)O
| PubChem CID | 259624 |
|---|---|
| CAS | 3724-19-4 |
| Molecular Weight (g/mol) | 151.165 |
| MDL Number | MFCD00274197 |
| SMILES | C1=CC(=CN=C1)CCC(=O)O |
| Synonym | 3-3-pyridyl propionic acid,3-pyridinepropionic acid,3-pyridinepropanoic acid,3-pyridin-3-yl propanoic acid,3-3-pyridyl propionicacid,pyridine-3-propionic acid,3-3-pyridyl propanoic acid,3-pyridin-3-yl propionic acid,pubchem8701,maybridge4_001332 |
| IUPAC Name | 3-pyridin-3-ylpropanoic acid |
| InChI Key | WDGXIUUWINKTGP-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO2 |
Methyl Dichloromethoxyacetate 95.0+%, TCI America™
CAS: 17640-25-4 Molecular Formula: C4H6Cl2O3 Molecular Weight (g/mol): 172.989 MDL Number: MFCD00012202 InChI Key: FWIGIASHGJFYOL-UHFFFAOYSA-N PubChem CID: 2724502 IUPAC Name: methyl 2,2-dichloro-2-methoxyacetate SMILES: COC(=O)C(OC)(Cl)Cl
| PubChem CID | 2724502 |
|---|---|
| CAS | 17640-25-4 |
| Molecular Weight (g/mol) | 172.989 |
| MDL Number | MFCD00012202 |
| SMILES | COC(=O)C(OC)(Cl)Cl |
| IUPAC Name | methyl 2,2-dichloro-2-methoxyacetate |
| InChI Key | FWIGIASHGJFYOL-UHFFFAOYSA-N |
| Molecular Formula | C4H6Cl2O3 |
Ethyl Tiglate 98.0+%, TCI America™
CAS: 5837-78-5 Molecular Formula: C7H12O2 Molecular Weight (g/mol): 128.171 MDL Number: MFCD00015183 InChI Key: OAPHLAAOJMTMLY-GQCTYLIASA-N Synonym: ethyl tiglate,tiglic acid, ethyl ester,ethyl 2-methylcrotonate,ethyl alpha-methylcrotonate,ethyl trans-2-methyl-2-butenoate,e-2-methyl-2-butenoic acid ethyl ester,ethyl e-2-methylcrotonate,ethyl trans-2-methylcrotonate,tiglic acid ethyl ester,ethyl 2-methylbut-2-enoate PubChem CID: 5281163 ChEBI: CHEBI:4892 IUPAC Name: ethyl (E)-2-methylbut-2-enoate SMILES: CCOC(=O)C(=CC)C
| PubChem CID | 5281163 |
|---|---|
| CAS | 5837-78-5 |
| Molecular Weight (g/mol) | 128.171 |
| ChEBI | CHEBI:4892 |
| MDL Number | MFCD00015183 |
| SMILES | CCOC(=O)C(=CC)C |
| Synonym | ethyl tiglate,tiglic acid, ethyl ester,ethyl 2-methylcrotonate,ethyl alpha-methylcrotonate,ethyl trans-2-methyl-2-butenoate,e-2-methyl-2-butenoic acid ethyl ester,ethyl e-2-methylcrotonate,ethyl trans-2-methylcrotonate,tiglic acid ethyl ester,ethyl 2-methylbut-2-enoate |
| IUPAC Name | ethyl (E)-2-methylbut-2-enoate |
| InChI Key | OAPHLAAOJMTMLY-GQCTYLIASA-N |
| Molecular Formula | C7H12O2 |
Vinyl 2-Ethylhexanoate (stabilized with MEHQ) 98.0+%, TCI America™
CAS: 94-04-2 Molecular Formula: C10H18O2 Molecular Weight (g/mol): 170.252 MDL Number: MFCD00009488 InChI Key: IGBZOHMCHDADGY-UHFFFAOYSA-N Synonym: 2-Ethylhexanoic Acid Vinyl Ester PubChem CID: 62343 IUPAC Name: ethenyl 2-ethylhexanoate SMILES: CCCCC(CC)C(=O)OC=C
| PubChem CID | 62343 |
|---|---|
| CAS | 94-04-2 |
| Molecular Weight (g/mol) | 170.252 |
| MDL Number | MFCD00009488 |
| SMILES | CCCCC(CC)C(=O)OC=C |
| Synonym | 2-Ethylhexanoic Acid Vinyl Ester |
| IUPAC Name | ethenyl 2-ethylhexanoate |
| InChI Key | IGBZOHMCHDADGY-UHFFFAOYSA-N |
| Molecular Formula | C10H18O2 |
2,2,3,3-Tetramethylcyclopropanecarboxylic Acid 98.0+%, TCI America™
CAS: 15641-58-4 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.198 MDL Number: MFCD00011538 InChI Key: SFHVXKNMCGSLAR-UHFFFAOYSA-N Synonym: 2,2,3,3-tetramethylcyclopropanecarboxylic acid,tetramethylcyclopropane-1-carboxylic acid,cyclopropanecarboxylic acid, 2,2,3,3-tetramethyl,2,2,3,3-tetramethylcyclopropanecarboxylicacid,acmc-1c48r,tetramethylcyclopropanecarboxylicacid,3-carboxy-1,1,2,2-tetramethylcyclopropane,2,2,3,3-tetramethyl cyclopropanecarboxylic acid,2,2,3,3-tetramethyl-cyclopropanecarboxylic acid,2,2,3,3-tetramethylcyclopropane carboxylic acid PubChem CID: 152115 ChEBI: CHEBI:39355 IUPAC Name: 2,2,3,3-tetramethylcyclopropane-1-carboxylic acid SMILES: CC1(C(C1(C)C)C(=O)O)C
| PubChem CID | 152115 |
|---|---|
| CAS | 15641-58-4 |
| Molecular Weight (g/mol) | 142.198 |
| ChEBI | CHEBI:39355 |
| MDL Number | MFCD00011538 |
| SMILES | CC1(C(C1(C)C)C(=O)O)C |
| Synonym | 2,2,3,3-tetramethylcyclopropanecarboxylic acid,tetramethylcyclopropane-1-carboxylic acid,cyclopropanecarboxylic acid, 2,2,3,3-tetramethyl,2,2,3,3-tetramethylcyclopropanecarboxylicacid,acmc-1c48r,tetramethylcyclopropanecarboxylicacid,3-carboxy-1,1,2,2-tetramethylcyclopropane,2,2,3,3-tetramethyl cyclopropanecarboxylic acid,2,2,3,3-tetramethyl-cyclopropanecarboxylic acid,2,2,3,3-tetramethylcyclopropane carboxylic acid |
| IUPAC Name | 2,2,3,3-tetramethylcyclopropane-1-carboxylic acid |
| InChI Key | SFHVXKNMCGSLAR-UHFFFAOYSA-N |
| Molecular Formula | C8H14O2 |
Allyl Trifluoroacetate 95.0+%, TCI America™
CAS: 383-67-5 Molecular Formula: C5H5F3O2 Molecular Weight (g/mol): 154.088 MDL Number: MFCD00013567 InChI Key: XIVPVSIDXBTZLM-UHFFFAOYSA-N Synonym: allyl trifluoroacetate,allyl trifluoracetate,trifluoroacetic acid allyl ester,prop-2-en-1-yl 2,2,2-trifluoroacetate,allyltrifluoroacetate,pubchem12548,acmc-209izu,allyl alcohol, trifluoroacetate,acetic acid, trifluoro-, allyl ester PubChem CID: 67845 IUPAC Name: prop-2-enyl 2,2,2-trifluoroacetate SMILES: C=CCOC(=O)C(F)(F)F
| PubChem CID | 67845 |
|---|---|
| CAS | 383-67-5 |
| Molecular Weight (g/mol) | 154.088 |
| MDL Number | MFCD00013567 |
| SMILES | C=CCOC(=O)C(F)(F)F |
| Synonym | allyl trifluoroacetate,allyl trifluoracetate,trifluoroacetic acid allyl ester,prop-2-en-1-yl 2,2,2-trifluoroacetate,allyltrifluoroacetate,pubchem12548,acmc-209izu,allyl alcohol, trifluoroacetate,acetic acid, trifluoro-, allyl ester |
| IUPAC Name | prop-2-enyl 2,2,2-trifluoroacetate |
| InChI Key | XIVPVSIDXBTZLM-UHFFFAOYSA-N |
| Molecular Formula | C5H5F3O2 |