| CAS Number | 75322-09-7 |
| Catalog Number | AG018RW8(AGN-PC-0MXN6V) |
| Chemical Name | 3-(Cyclohexyloxy)propan-1-ol |
| IUPAC Name | 3-cyclohexyloxypropan-1-ol |
| InChI | InChI=1S/C9H18O2/c10-7-4-8-11-9-5-2-1-3-6-9/h9-10H,1-8H2 |
| InChI Key | JZISPFMRVBHTCH-UHFFFAOYSA-N |
| MDL Number | MFCD10686877 |
| Molecular Formula | C9H18O2 |
| Molecular Weight | 158.2380 |
| SMILES | OCCCOC1CCCCC1 |
| Synonyms | 3-(cyclohexyloxy)propan-1-ol,
75322-09-7,
3-cyclohexyloxypropyl alcohol,
3-cyclohexyloxypropan-1-ol,
AC1Q7CUS,
3-Cyclohexyloxy-propan-1-ol,
SCHEMBL386704,
3-(cyclohexoxy)-propan-1-ol,
3-(cyclohexyloxy)-1-propanol,
JZISPFMRVBHTCH-UHFFFAOYSA-N,
ZINC20283477,
AKOS009254416,
EN300-36269,
A1-04662,
F8881-1665,
Z1954802560,
CID10034878,
|
| Complexity | 87.6 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 158.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 158.241g/mol |
| Monoisotopic Mass | 158.131g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number