5-Indanol
PubChem CID: 15118
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| Compound Synonyms | 5-INDANOL, 1470-94-6, 2,3-dihydro-1H-inden-5-ol, Indan-5-ol, 5-Hydroxyindan, 5-Hydroxyhydrindene, 1H-Inden-5-ol, 2,3-dihydro-, 5-Hydroxyindane, NSC 9775, EINECS 216-006-3, MFCD00003802, BRN 1936314, DTXSID0051732, CHEBI:59311, AI3-39160, 9Z94H6F15T, NSC-9775, 2,3-dihydroinden-5-ol, DTXCID6030287, 4-06-00-03829 (Beilstein Handbook Reference), Indanol-5, 5Hydroxyindan, UNII-9Z94H6F15T, Indan5ol, 5Hydroxyhydrindene, NSC9775, 5-Indanol, 99%, 1HInden5ol, 2,3dihydro, WLN: L56T&J GQ, 1H-Inden-5-ol,3-dihydro-, SCHEMBL281714, CHEMBL3218378, Tox21_303902, AKOS005207221, AC-4785, FI42892, NCGC00357155-01, AS-44253, SY049594, CAS-1470-94-6, DB-042868, DB-063694, CS-0214750, H0251, NS00003561, EN300-19024, A10309, Q27126618, InChI=1/C9H10O/c10-9-5-4-7-2-1-3-8(7)6-9/h4-6,10H,1-3H, 216-006-3 |
|---|---|
| Topological Polar Surface Area | 20.2 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 10.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 122.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2,3-dihydro-1H-inden-5-ol |
| Prediction Hob | 1.0 |
| Xlogp | 2.4 |
| Molecular Formula | C9H10O |
| Prediction Swissadme | 0.0 |
| Inchi Key | PEHSSTUGJUBZBI-UHFFFAOYSA-N |
| Fcsp3 | 0.3333333333333333 |
| Logs | -2.006 |
| Rotatable Bond Count | 0.0 |
| Logd | 2.467 |
| Compound Name | 5-Indanol |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 134.073 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 134.073 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 134.17 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.6027036 |
| Inchi | InChI=1S/C9H10O/c10-9-5-4-7-2-1-3-8(7)6-9/h4-6,10H,1-3H2 |
| Smiles | C1CC2=C(C1)C=C(C=C2)O |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Syzygium Aromaticum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all