Basic information
- Standard SMILES
Cc1nc2c(C)cc(O)c(C(C)C)c2o1- InChIKey
CCBAZLGYNBXBQY-UHFFFAOYSA-N- Molecular formula
- C12H15NO2
- Average molar mass
- 205.25 g/mol
Names & identifiers
- Preferred name
- 7-Isopropyl-2,4-dimethyl-benzooxazol-6-ol
- IUPAC
- 2,4-dimethyl-7-propan-2-yl-1,3-benzoxazol-6-ol
Names & synonyms
SCHEMBL1493853CCBAZLGYNBXBQY-UHFFFAOYSA-N865306-06-57-isopropyl-2,4-dimethyl-benzooxazol-6-olDB-116468
Database identifiers
- PubChem CID
- 59598632
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 232
Related reactions
4 records
Compound notes
Loading…