Basic information
- CAS
192380-09-9- Standard SMILES
OC1CN2CCCC1C2- InChIKey
ROZOWQBTMUUFPZ-UHFFFAOYSA-N- Molecular formula
- C7H13NO
- Average molar mass
- 127.18 g/mol
- Monoisotopic mass
- 127.09971404
Names & identifiers
- Preferred name
- 1-Azabicyclo[3.2.1]octan-6-ol
- IUPAC
- 1-azabicyclo[3.2.1]octan-6-ol
- English name
- 1-Azabicyclo[3.2.1]octan-6-ol(9CI)
- Molecular formula
- C7H13NO
- Molecular weight
- 127.18
Names & synonyms
1-azabicyclo[3.2.1]octan-6-ol192380-09-91-Azabicyclo[3.2.1]octan-6-ol,1-Azabicyclo[3.2.1]octan-6-ol(9CI)SCHEMBL4528256DTXSID30337912EN300-118489
Database identifiers
- CAS
192380-09-9- PubChem CID
- 545499
- DTXSID
DTXSID30337912
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 115
Physicochemical properties
- Melting point
- 177 · 177-179 °C
- Boiling point
- 206.9 · 206.9±23.0 °C(Predicted)
- Density
- 1.13 · 1.13±0.1 g/cm3(Predicted)
- pka
- 14.95 · 14.95±0.20(Predicted)
Chemistry & industry
Suppliers1 total
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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