
CAS Number91587-01-8
Synonyms(E)-4-[4-methyl-6-(2,6,6-trimethyl-1-cyclohexen-1-yl)-1,3,5-hexatrienyl]benzoic acid; (E,E)-4-[4-methyl-6-(2,6,6-trimethyl-1-cyclohexen-1-yl)-1,3,5-hexatrienyl] benzoic acid; (all-E)-1-(4-Carboxyphenyl)-4-methyl-6-(2,6,6-trimethyl-1-cyclohexen-1-yl)-1,3,5-hexatriene; PELRETIN; 4-[(E)-4-methyl-6-(2,6,6-trimethylcyclohexenyl)-1,3,5-hexatrienyl]benzoic acid; Pelretin (USAN/INN)
Molecular FormulaC23H28O2
Molecular Weight336.47
Purity98.00%
Density1.07g/cm3
Boiling Point506.4ºC at 760mmHg
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 91587-01-8 |
| Catalog No. | 2A-9011900 |
| Chinese Name | 培维A |
| Synonyms | (E)-4-[4-methyl-6-(2,6,6-trimethyl-1-cyclohexen-1-yl)-1,3,5-hexatrienyl]benzoic acid; (E,E)-4-[4-methyl-6-(2,6,6-trimethyl-1-cyclohexen-1-yl)-1,3,5-hexatrienyl] benzoic acid; (all-E)-1-(4-Carboxyphenyl)-4-methyl-6-(2,6,6-trimethyl-1-cyclohexen-1-yl)-1,3,5-hexatriene; PELRETIN; 4-[(E)-4-methyl-6-(2,6,6-trimethylcyclohexenyl)-1,3,5-hexatrienyl]benzoic acid; Pelretin (USAN/INN) |
| Molecular Formula | C23H28O2 |
| Molecular Weight | 336.47 |
| Purity | 98.00 |
| Density | 1.07g/cm3 |
| Boiling Point | 506.4ºC at 760mmHg |
| MDL Number | C23H28O2 |
| SMILES | CC(C=CC1=C(C)CCCC1(C)C)=CC=Cc1ccc(C(=O)O)cc1 |
| InChI | InChI=1S/C23H28O2/c1-17(10-15-21-18(2)8-6-16-23(21,3)4)7-5-9-19-11-13-20(14-12-19)22(24)25/h5,7,9-15H,6,8,16H2,1-4H3,(H,24,25)/b9-5+,15-10+,17-7+ |
| InChI Key | YRNAHKPMDMVFMV-GMICYETFSA-N |
| MSDS | msds/11900_1_91587_01_8.pdf |
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