| CAS Number | 60834-87-9 |
| Catalog Number | AG01B23W(AGN-PC-03S645) |
| Chemical Name | 3-Cyclopentylphenol |
| IUPAC Name | 3-cyclopentylphenol |
| InChI | InChI=1S/C11H14O/c12-11-7-3-6-10(8-11)9-4-1-2-5-9/h3,6-9,12H,1-2,4-5H2 |
| InChI Key | NZJMQFDGADIRLV-UHFFFAOYSA-N |
| MDL Number | MFCD20412449 |
| Molecular Formula | C11H14O |
| Molecular Weight | 162.2283 |
| SMILES | OC1=CC(C2CCCC2)=CC=C1 |
| Synonyms | 3-cyclopentylphenol,
60834-87-9,
meta-cyclopentylphenol,
3-cyclopentyl-phenol,
Phenol, 3-cyclopentyl-,
SCHEMBL1661863,
NZJMQFDGADIRLV-UHFFFAOYSA-N,
ZINC72193163,
AKOS015946692,
A1-02927,
Z2469998756,
Phenol,3-cyclopentyl-,
|
| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 162.104g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 162.232g/mol |
| Monoisotopic Mass | 162.104g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number