CAS 13382-54-2 2-Chloro-6-phenylpyridine (HCID 2762880)

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Basic information

CAS: 13382-54-2
Standard SMILES: Clc1cccc(-c2ccccc2)n1
InChIKey: YTAGJMFBUAHVDP-UHFFFAOYSA-N
Molecular formula: C11H8ClN
Average molar mass: 189.64 g/mol
Monoisotopic mass: 189.03452694

Names & identifiers

Preferred name: 2-Chloro-6-phenylpyridine
IUPAC: 2-chloro-6-phenylpyridine
English name: 2-CHLORO-6-PHENYLPYRIDINE
Molecular formula: C11H8ClN
Molecular weight: 189.64

Names & synonyms

2-chloro-6-phenylpyridine13382-54-2DTXSID20376537RefChem:259153DTXCID803275652-chloro-6-phenyl-pyridine6-chloro-2-phenylpyridineMFCD01646086Abametapir Impurity 82-Chloro-6-phenyl pyrdineSCHEMBL732652Pyridine, 2-chloro-6-phenyl-

Show more names

SCHEMBL1274804SCHEMBL1662450SCHEMBL6134664YTAGJMFBUAHVDP-UHFFFAOYSA-NSBB091020AKOS006279552AB09567BS-36784

Database identifiers

CAS: 13382-54-2
PubChem CID: 2762880
DTXSID: DTXSID20376537
Nikkaji: J1.306.949B

Properties

Computed structural properties

XLogP: 3.5
Topological polar surface area: 12.9 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 13
Formal charge: 0
Complexity: 154

Physicochemical properties

Melting point: 157 · 157-159℃
Boiling point: 307 ℃ · 307℃
Density: 1.186 · 1.186
Flash point: 168 ℃ · 168℃
storage temp.: 2 · 2-8°C
pka: -0.17 · -0.17±0.10(Predicted)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H335
Precautionary statements: 261 · P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P362-P403+P233-P501

Safety & regulation

Safety data

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H315-H319-H335
Precautionary statements: P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P362-P403+P233-P501