6-Benzoxazolol, 4,5,6,7-tetrahydro-2-methyl-
Basic information
- CAS
1782829-27-9- Standard SMILES
Cc1nc2c(o1)CC(O)CC2- InChIKey
OQBDJCHVCONBRF-UHFFFAOYSA-N- Molecular formula
- C8H11NO2
- Average molar mass
- 153.18 g/mol
- Monoisotopic mass
- 153.07897859
Names & identifiers
- Preferred name
- 6-Benzoxazolol, 4,5,6,7-tetrahydro-2-methyl-
- IUPAC
- 2-methyl-4,5,6,7-tetrahydro-1,3-benzoxazol-6-ol
Names & synonyms
6-Benzoxazolol, 4,5,6,7-tetrahydro-2-methyl-1782829-27-9DTXSID8012579932-Methyl-4,5,6,7-tetrahydro-1,3-benzoxazol-6-ol
Database identifiers
- CAS
1782829-27-9- PubChem CID
- 84649751
- DTXSID
DTXSID801257993
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 151
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…