6-Methylindan-4-ol
PubChem CID: 88474
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| Compound Synonyms | 6-Methylindan-4-ol, 6-Methyl-4-indanol, 20294-32-0, EINECS 243-705-0, 6-methyl-2,3-dihydro-1H-inden-4-ol, 4-Indanol, 6-methyl-, 2,3-Dihydro-6-methyl-1H-inden-4-ol, 1H-Inden-4-ol, 2,3-dihydro-6-methyl-, DTXSID60174175, SCHEMBL3600359, DTXCID3096666, NS00026579, 243-705-0 |
|---|---|
| Ghose Rule | False |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 20.2 |
| Hydrogen Bond Donor Count | 1.0 |
| Pfizer 3 75 Rule | False |
| Scaffold Graph Level | C1CCC2CCCC2C1 |
| Deep Smiles | CcccO)ccc6)CCC5 |
| Heavy Atom Count | 11.0 |
| Classyfire Class | Indanes |
| Scaffold Graph Node Level | C1CCC2CCCC2C1 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 144.0 |
| Database Name | imppat_phytochem;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 6-methyl-2,3-dihydro-1H-inden-4-ol |
| Veber Rule | True |
| Classyfire Superclass | Benzenoids |
| Xlogp | 2.8 |
| Gsk 4 400 Rule | True |
| Molecular Formula | C10H12O |
| Scaffold Graph Node Bond Level | c1ccc2c(c1)CCC2 |
| Inchi Key | ZYSDYEFSMQZMQA-UHFFFAOYSA-N |
| Silicos It Class | Soluble |
| Rotatable Bond Count | 0.0 |
| Synonyms | 6-methyl-4-indanol |
| Esol Class | Soluble |
| Functional Groups | cO |
| Compound Name | 6-Methylindan-4-ol |
| Exact Mass | 148.089 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 148.089 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 148.2 |
| Gi Absorption | True |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Lipinski Rule Of 5 | True |
| Inchi | InChI=1S/C10H12O/c1-7-5-8-3-2-4-9(8)10(11)6-7/h5-6,11H,2-4H2,1H3 |
| Smiles | CC1=CC2=C(CCC2)C(=C1)O |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | True |
- 1. Outgoing r'ship
FOUND_INto/from Adansonia Digitata (Plant) Rel Props:Reference:https://doi.org/10.1016/j.lwt.2018.03.014