Basic information
- CAS
102997-00-2- Standard SMILES
OC1CNCCc2sccc21- InChIKey
DDPZHHCKZWIJJB-UHFFFAOYSA-N- Molecular formula
- C8H11NOS
- Average molar mass
- 169.25 g/mol
- Monoisotopic mass
- 169.05613515
Names & identifiers
- Preferred name
- 4H-Thieno[2,3-d]azepin-4-ol, 5,6,7,8-tetrahydro-
- IUPAC
- 5,6,7,8-tetrahydro-4H-thieno[2,3-d]azepin-4-ol
Names & synonyms
102997-00-25,6,7,8-Tetrahydro-4H-thieno[2,3-d]azepin-4-ol4H-Thieno[2,3-d]azepin-4-ol, 5,6,7,8-tetrahydro-4H,5H,6H,7H,8H-Thieno[2,3-d]azepin-4-olMFCD20662640starbld0014804SCHEMBL2835154DTXSID60469790DDPZHHCKZWIJJB-UHFFFAOYSA-NAKOS030255258[rac]-5,6,7,8-tetrahydro-4H-thieno[2,3-d]azepin-4-ol
Database identifiers
- CAS
102997-00-2- PubChem CID
- 11636878
- DTXSID
DTXSID60469790
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 60.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 142
Related reactions
3 records
Compound notes
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