1,5-Diphenylpentan-3-ol
PubChem CID: 12838510
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| Compound Synonyms | 1,5-diphenylpentan-3-ol, 17486-86-1, 1,5-Diphenyl-3-Pentanol, 1.5-Diphenyl-3-pentanol, 1, 5-diphenylpentan-3-ol, 1,5-Diphenyl-pentan-3-ol, SCHEMBL4799370, 1, 5-Diphenyl- 3 -pentanol, YDNNOTNUWKPRNH-UHFFFAOYSA-N, SAA48686, AKOS010644503, CS-0231242, EN300-107529, G49056, Z815261698, 973-641-5 |
|---|---|
| Topological Polar Surface Area | 20.2 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 18.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 180.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 1,5-diphenylpentan-3-ol |
| Prediction Hob | 1.0 |
| Xlogp | 4.2 |
| Molecular Formula | C17H20O |
| Prediction Swissadme | 1.0 |
| Inchi Key | YDNNOTNUWKPRNH-UHFFFAOYSA-N |
| Fcsp3 | 0.2941176470588235 |
| Logs | -4.198 |
| Rotatable Bond Count | 6.0 |
| Logd | 3.679 |
| Compound Name | 1,5-Diphenylpentan-3-ol |
| Prediction Hob Swissadme | 1.0 |
| Exact Mass | 240.151 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 240.151 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 240.34 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -4.092378533333333 |
| Inchi | InChI=1S/C17H20O/c18-17(13-11-15-7-3-1-4-8-15)14-12-16-9-5-2-6-10-16/h1-10,17-18H,11-14H2 |
| Smiles | C1=CC=C(C=C1)CCC(CCC2=CC=CC=C2)O |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Ipomoea Nil (Plant) Rel Props:Source_db:cmaup_ingredients