2-(1-Cyclohexen-1-yl)pyridine
Basic information
- CAS
14159-55-8- Standard SMILES
C1=C(c2ccccn2)CCCC1- InChIKey
RMSSVEWIIHKOQK-UHFFFAOYSA-N- Molecular formula
- C11H13N
- Average molar mass
- 159.23 g/mol
- Monoisotopic mass
- 159.10479942
Names & identifiers
- Preferred name
- 2-(1-Cyclohexen-1-yl)pyridine
- IUPAC
- 2-(cyclohexen-1-yl)pyridine
- English name
- 2-(1-cyclohexen-1-yl)pyridine
- Molecular formula
- C11H13N
- Molecular weight
- 159.23
Names & synonyms
14159-55-82-(1-Cyclohexen-1-yl)pyridineEINECS 238-002-0DTXSID60161767RefChem:83813DTXCID2084258238-002-02-(cyclohex-1-en-1-yl)pyridine2-(cyclohexen-1-yl)pyridinePyridine, 2-(1-cyclohexen-1-yl)-cyclohexenylpyridine1-(2-Pyridyl)cyclohexene
Show more names
2-(1-Cyclohexenyl)pyridine
73UL5QV49SSCHEMBL7071127SCHEMBL7504039SCHEMBL30374920PAA15955AT44381DB-407926CS-0240198
Database identifiers
- CAS
14159-55-8- PubChem CID
- 84228
- DTXSID
DTXSID60161767- UNII
- 73UL5QV49S
- EC Number
- 238-002-0
- Nikkaji
- J216.886C
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 172
Physicochemical properties
- Boiling point
- 155 °C · 155 °C(Press: 31 Torr)
- Density
- 1.033 g/cm3 · 1.033 g/cm3
- pka
- 5.96 · 5.96±0.19(Predicted)
- FDA UNII
- 73 UL5QV49S · 73UL5QV49S
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: Pyridine, 2-(1-cyclohexen-1-yl)-
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
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