| CAS Number | 4916-86-3 |
| Catalog Number | AG019Z83(AGN-PC-0WOCLR) |
| Chemical Name | 2-(3-methylcyclohexyl)ethan-1-ol |
| IUPAC Name | 2-(3-methylcyclohexyl)ethanol |
| InChI | InChI=1S/C9H18O/c1-8-3-2-4-9(7-8)5-6-10/h8-10H,2-7H2,1H3 |
| InChI Key | IENBTXGZXJUUMG-UHFFFAOYSA-N |
| MDL Number | MFCD20281658 |
| Molecular Formula | C9H18O |
| Molecular Weight | 142.2386 |
| SMILES | CC1CC(CCO)CCC1 |
| Synonyms | 2-(3-methylcyclohexyl)ethan-1-ol,
4916-86-3,
2-(3-methyl-cyclohexyl)-ethanol,
SCHEMBL6468932,
AKOS013571175,
MCULE-3392494912,
NE20303,
Z1406872867,
|
| Complexity | 90.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 142.136g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 142.242g/mol |
| Monoisotopic Mass | 142.136g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number