Basic information
- CAS
1208220-82-9- Standard SMILES
O=C(O)C1(c2ccccn2)CCCCC1- InChIKey
PMNAKOXEHLRPEE-UHFFFAOYSA-N- Molecular formula
- C12H15NO2
- Average molar mass
- 205.25 g/mol
- Monoisotopic mass
- 205.11027872
Names & identifiers
- Preferred name
- 1-(Pyridin-2-yl)cyclohexanecarboxylic acid
- IUPAC
- 1-pyridin-2-ylcyclohexane-1-carboxylic acid
- English name
- 1-(pyridin-2-yl)cyclohexanecarboxylic acid
- Molecular formula
- C12H15NO2
- Molecular weight
- 205.25
Names & synonyms
1208220-82-91-(pyridin-2-yl)cyclohexanecarboxylic acid1-Pyridin-2-ylcyclohexane-1-carboxylic acid1-(pyridin-2-yl)cyclohexane-1-carboxylic acidSCHEMBL28059197AT403051-(2-Pyridinyl)cyclohexanecarboxylic acidCyclohexanecarboxylic acid, 1-(2-pyridinyl)-
Database identifiers
- CAS
1208220-82-9- PubChem CID
- 45598113
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 50.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 234
Physicochemical properties
- Density
- 1.175 · 1.175
Chemistry & industry
Suppliers5 total
海济医药科技（苏州）有限公司18012778619 · [email protected]
上海拓朴医药科技有限公司+86 (21) 5196-9732
重庆卡兰医药有限公司[email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
江苏药泽医药科技有限公司18550739526 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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