4-Benzoyl-4'-bromobiphenyl
Basic information
- CAS
63242-14-8- Standard SMILES
O=C(c1ccccc1)c1ccc(-c2ccc(Br)cc2)cc1- InChIKey
ITMLYLPKSFZCJK-UHFFFAOYSA-N- Molecular formula
- C19H13BrO
- Average molar mass
- 337.2 g/mol
- Monoisotopic mass
- 336.01498
Names & identifiers
- Preferred name
- 4-Benzoyl-4'-bromobiphenyl
- IUPAC
- [4-(4-bromophenyl)phenyl]-phenylmethanone
- English name
- 4-BENZOYL-4'-BROMOBIPHENYL
- Molecular formula
- C19H13BrO
- Molecular weight
- 337.21
Names & synonyms
4-Benzoyl-4'-bromobiphenyl63242-14-8DTXSID00333062RefChem:290273DTXCID30284154(4'-Bromo-[1,1'-biphenyl]-4-yl)(phenyl)methanone[4-(4-bromophenyl)phenyl]-phenylmethanoneMFCD00209630[4-(4-bromophenyl)phenyl]-phenyl-methanone4-(4-bromophenyl)phenyl phenyl ketone4-(4-Bromophenyl)benzophenone{4'-BROMO-[1,1'-BIPHENYL]-4-YL}(PHENYL)METHANONE
Show more names
LABOTEST-BB LT011434144-Benzoyl-4'-bromobiphenyl >[4-(4-bromophenyl)phenyl]-phenylmethanone4-Benzoyl-4′-bromobiphenyl, CAS 63242-14-8Methanone, (4'-bromo[1,1'-biphenyl]-4-yl)phenyl-
(4'-bromobiphenyl-4-yl)(phenyl)methanoneSCHEMBL177252SBB058420AKOS015890115AS-67717SY048826DB-054438CS-0315729
Database identifiers
- CAS
63242-14-8- PubChem CID
- 478901
- DTXSID
DTXSID00333062- Nikkaji
- J1.257.624B
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 331
Physicochemical properties
- Melting point
- 157 · 157-161 °C(lit.)
- Boiling point
- 459.6 · 459.6±28.0 °C(Predicted)
- Density
- 1.354 · 1.354±0.06 g/cm3(Predicted)
- form
- powder to crystal
- color
- Light yellow to Yellow to Orange
- BRN
- 2378429 · 2378429
- CAS DataBase Reference
- 63242 · 63242-14-8(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- WGK Germany
- 3 · 3
- HS Code
- 2902900000 · 2902900000
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
- hs_code
- 2902900000
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
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Compound notes
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