ChemicalBook--->CAS DataBase List--->2567-29-5

2567-29-5

2567-29-5 Structure

2567-29-5 Structure
IdentificationMore
[Name]

4-BROMOMETHYLBIPHENYL
[CAS]

2567-29-5
[Synonyms]

4-BROMOMETHYLBIPHENYL
4-PHENYLBENZYL BROMIDE
4-Bromoethylbiphenyl
Bromoethylbiphenyl
1,1-Biphenyl, 4-(bromomethyl)-
Bromoethylbiphenyl 98%
4-BROMOMETHYLBIPHENYL 98+%
p-Phenylbenzyl bromide
[Molecular Formula]

C13H11Br
[MDL Number]

MFCD00017869
[Molecular Weight]

247.13
[MOL File]

2567-29-5.mol
Chemical PropertiesBack Directory
[Appearance]

Pale yellow to beige powder
[Melting point ]

83-86 °C
[Boiling point ]

140 °C / 10mmHg
[density ]

1.341±0.06 g/cm3(Predicted)
[Fp ]

>110℃
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[solubility ]

Chloroform, Methanol
[form ]

Powder
[color ]

Pale yellow to beige
[InChI]

InChI=1S/C13H11Br/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9H,10H2
[InChIKey]

HZQLUIZFUXNFHK-UHFFFAOYSA-N
[SMILES]

C1(C2=CC=CC=C2)=CC=C(CBr)C=C1
[CAS DataBase Reference]

2567-29-5(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319
[Precautionary statements ]

P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S37/39:Wear suitable gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
[RIDADR ]

3261
[HazardClass ]

IRRITANT
[HS Code ]

29029090
Hazard InformationBack Directory
[Chemical Properties]

Pale yellow to beige powder
[Uses]

4-(Bromomethyl)biphenyl is a biphenyl derivative used in the preparation of various pharmaceutical compounds such as protein tyrosine phosphatase 1B inhibitors. 4-(Bromomethyl)biphenyl is useful as as atom transfer radical polymerization initiator.
[Synthesis]

4-Biphenylmethanol

3597-91-9

4-BROMOMETHYLBIPHENYL

2567-29-5

General procedure for the synthesis of 4-bromomethylbiphenyl from 4-biphenylmethanol: Carbon tetrabromide (8.99 g, 27.1 mmol) and triphenylphosphine (7.11 g, 27.1 mmol) were sequentially added to a solution of dichloromethane (100 mL) containing biphenyl-4-ylmethanol (5.00 g, 27.1 mmol) at room temperature with continuous stirring. The reaction mixture was stirred at room temperature for 1.5 h before the solvent was removed by distillation under reduced pressure. The resulting crude product was purified by silica gel column chromatography with an eluent ratio of 1:20 ether/cyclohexane, resulting in 4-bromomethylbiphenyl (6.37 g, 95% yield) as a white solid.1H NMR (400 MHz, CDCl3) data were as follows: δ 7.60 (4H), 7.45 (4H), 7.35 (1H), 4.55 (2H).

[References]

[1] Organic Letters, 2013, vol. 15, # 9, p. 2210 - 2213
[2] Patent: WO2005/26120, 2005, A1. Location in patent: Page/Page column 21
[3] Patent: WO2004/110974, 2004, A1. Location in patent: Page 22
[4] Organic Letters, 2012, vol. 14, # 21, p. 5428 - 5431,4
[5] Organic Letters, 2018, vol. 20, # 10, p. 3061 - 3064
Spectrum DetailBack Directory
[Spectrum Detail]

4-BROMOMETHYLBIPHENYL(2567-29-5)MS
4-BROMOMETHYLBIPHENYL(2567-29-5)1HNMR
4-BROMOMETHYLBIPHENYL(2567-29-5)13CNMR
4-BROMOMETHYLBIPHENYL(2567-29-5)IR1
4-BROMOMETHYLBIPHENYL(2567-29-5)IR2
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

4-(Bromomethyl)biphenyl, 96%(2567-29-5)
[TCI AMERICA]

4-Bromomethylbiphenyl,>98.0%(GC)(2567-29-5)
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