Basic information
- CAS
540772-00-7- Standard SMILES
Cc1nc2n(c1O)CCCCC2- InChIKey
ONLCGBIHXIHJOO-UHFFFAOYSA-N- Molecular formula
- C9H14N2O
- Average molar mass
- 166.22 g/mol
- Monoisotopic mass
- 166.11061307
Names & identifiers
- Preferred name
- 2-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-3-ol
- IUPAC
- 2-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-3-ol
- English name
- 5H-Imidazo[1,2-a]azepin-3-ol,6,7,8,9-tetrahydro-2-methyl-(9CI)
- Molecular formula
- C9H14N2O
- Molecular weight
- 166.22
Names & synonyms
540772-00-7MFCD03459984AKOS001752283DB-3253505H-IMIDAZO[1,2-A]AZEPIN-3-OL, 6,7,8,9-TETRAHYDRO-2-METHYL-5H-Imidazo[1,2-a]azepin-3-ol,6,7,8,9-tetrahydro-2-methyl-(9CI)
Database identifiers
- CAS
540772-00-7- PubChem CID
- 713758
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 38.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 163
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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