| CAS Number | 194794-54-2 |
| Catalog Number | AG01AHBF(AGN-PC-00FAY5) |
| Chemical Name | 5-(Benzyloxy)pentan-2-ol |
| IUPAC Name | 5-phenylmethoxypentan-2-ol |
| InChI | InChI=1S/C12H18O2/c1-11(13)6-5-9-14-10-12-7-3-2-4-8-12/h2-4,7-8,11,13H,5-6,9-10H2,1H3 |
| InChI Key | MQAOYJYQYFYYIE-UHFFFAOYSA-N |
| MDL Number | MFCD16146675 |
| Molecular Formula | C12H18O2 |
| Molecular Weight | 194.2701 |
| SMILES | CC(CCCOCC1=CC=CC=C1)O |
| Synonyms | 5-(benzyloxy)pentan-2-ol,
194794-54-2,
5-benzyloxypentan-2-ol,
5-(Benzyloxy)-2-pentanol,
SCHEMBL542039,
MQAOYJYQYFYYIE-UHFFFAOYSA-N,
AKOS011219010,
MCULE-3443600498,
NE28626,
EN300-74240,
Z1259161750,
162541-50-6,
5-phenylmethoxypentan-2-ol,
CID11745530,
|
| Complexity | 130 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 194.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 194.274g/mol |
| Monoisotopic Mass | 194.131g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number