Basic information
- CAS
54151-74-5- Standard SMILES
Brc1cc(-c2ccccc2)ccn1- InChIKey
KRIILKQTJUOQCJ-UHFFFAOYSA-N- Molecular formula
- C11H8BrN
- Average molar mass
- 234.09 g/mol
- Monoisotopic mass
- 232.98401136
Names & identifiers
- Preferred name
- 2-Bromo-4-phenylpyridine
- IUPAC
- 2-bromo-4-phenylpyridine
- English name
- 2-Bromo-4-phenylpyridine
- Molecular formula
- C11H8BrN
- Molecular weight
- 234.09
Names & synonyms
2-Bromo-4-phenylpyridinePyridine, 2-bromo-4-phenyl-DTXSID8068915RefChem:257264DTXCID304161354151-74-52-bromo-4-phenyl-pyridineMFCD002351592-bromo-4-phenyl pyridineSCHEMBL4993SCHEMBL28582294SCHEMBL30375140
Show more names
Methyl 2-bromo-4-phenylpyridine4-Phenyl-2-bromopyridine2-bromo-4-phenyl-pyridin2-bromine-4-phenylpyridine2-Bromo-4-phenylpyridine 97+%(2-Bromo-pyridin-4-yl)benzene
AKOS015899924DS-3922SY042835DB-081297CS-0006601EN300-219480F233124
Database identifiers
- CAS
54151-74-5- PubChem CID
- 104700
- DTXSID
DTXSID8068915- EC Number
- 187-825-0
- Nikkaji
- J429.241C
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 154
Physicochemical properties
- Melting point
- 65 · 65-66 °C(Solv: ligroine (8032-32-4))
- Boiling point
- 311.7 · 311.7±22.0 °C(Predicted)
- Density
- 1.426 · 1.426±0.06 g/cm3(Predicted)
- storage temp.
- Inert atmosphere,Room Temperature
- pka
- 0.96 · 0.96±0.10(Predicted)
- form
- powder
- color
- Yellow
- InChI
- InChI=1S/C11H8BrN/c12-11-8-10(6-7-13-11)9-4-2-1-3-5-9/h1-8H
- InChIKey
- KRIILKQTJUOQCJ-UHFFFAOYSA-N
- SMILES
- C1(Br)=NC=CC(C2=CC=CC=C2)=C1
- EPA Substance Registry System
- 2 · 2-Bromo-4-phenylpyridine (54151-74-5)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety data
- tsca
- TSCA listed
- hs_code
- 2933399990
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPyridine, 2-bromo-4-phenyl-: INACTIVE
Applications
Uses2-Bromo-4-phenylpyridine is used as an intermediate in organic synthesis and pharmaceuticals.
Upstream & downstream products
Upstream raw materials
Suppliers68 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海腾准生物科技有限公司19821570922 · [email protected]
宁波季诺化学品有限公司0574-87314919 057487319282 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Related reactions
12 records
Compound notes
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