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Thermo Scientific Chemicals
4-Isopropoxybenzoic acid, 99%
CAS: 13205-46-4 | C10H12O3 | 180.203 g/mol
化学物質識別子
CAS13205-46-4
IUPAC Name4-(propan-2-yloxy)benzoic acid
Molecular FormulaC10H12O3
InChI KeyZVERWTXKKWSSHH-UHFFFAOYSA-N
SMILESCC(C)OC1=CC=C(C=C1)C(O)=O
さらに表示
仕様
スペックシート
スペックシートAppearance (Color)White
FormCrystals or powder or crystalline powder
Assay (Aqueous acid-base Titration)≥98.5 to ≤101.5%
Assay (HPLC)≥98.5%
Melting Point (clear melt)161.0-167.0?C
4-Isopropoxybenzoic acid is used to prepare 5-(4-isopropoxyphenyl)-N-phenyl-1,3,4-thiadiazol-2-amine by reacting with N-phenylhydrazinecarbothioamide in the presence of phosphorusoxychloride.
This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.
Applications
4-Isopropoxybenzoic acid is used to prepare 5-(4-isopropoxyphenyl)-N-phenyl-1,3,4-thiadiazol-2-amine by reacting with N-phenylhydrazinecarbothioamide in the presence of phosphorusoxychloride.
Solubility
Insoluble in water.
Notes
Incompatible with strong oxidizing agents.
4-Isopropoxybenzoic acid is used to prepare 5-(4-isopropoxyphenyl)-N-phenyl-1,3,4-thiadiazol-2-amine by reacting with N-phenylhydrazinecarbothioamide in the presence of phosphorusoxychloride.
Solubility
Insoluble in water.
Notes
Incompatible with strong oxidizing agents.
RUO – Research Use Only
General References:
- Neubauer, S.; Rechenmacher, F.; Brimioulle, R.; Di Leva, F. S.; Bochen, A.; Sobahi, T. R.; Schottelius, M.; Novellino, E.; Mas-Moruno, C.; Marinelli, L.; Kessler, H. Pharmacophoric Modifications Lead to Superpotent alphavbeta3 Integrin Ligands with Suppressed alpha5beta1 Activity. J. Med. Chem. 2014, 57 (8), 3410-3417.
- Croxall, W. J.; Sowa, F. J.; Nieuwland, J. A. Organic Reactions with Boron Fluoride. XI. The Condensation of Propylene with m-and p-Hydroxybenzoic Acids. J. Am. Chem. Soc. 1935, 57 (9), 1549-1551.