| CAS Number | 92655-03-3 |
| Catalog Number | AG01AHZ8 |
| Chemical Name | 2-[1-(2-Phenylethyl)cyclopentyl]acetic acid |
| IUPAC Name | 2-[1-(2-phenylethyl)cyclopentyl]acetic acid |
| InChI | InChI=1S/C15H20O2/c16-14(17)12-15(9-4-5-10-15)11-8-13-6-2-1-3-7-13/h1-3,6-7H,4-5,8-12H2,(H,16,17) |
| InChI Key | QPMZEGFCQHYYPT-UHFFFAOYSA-N |
| MDL Number | MFCD16353445 |
| Molecular Formula | C15H20O2 |
| Molecular Weight | 232.3181 |
| SMILES | C1CCC(C1)(CCC2=CC=CC=C2)CC(=O)O |
| Synonyms | 2-[1-(2-phenylethyl)cyclopentyl]acetic acid,
92655-03-3,
ZINC40224529,
AKOS010303238,
MCULE-2317885418,
NE48125,
EN300-76218,
Z1259339769,
|
| Complexity | 248 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 232.146g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 232.323g/mol |
| Monoisotopic Mass | 232.146g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number