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4-Bromobenzyl alcohol

4-Bromobenzyl alcohol structure

CAS No:
873-75-6
Formula:
C7H7BrO
Chemical Name:
4-Bromobenzyl alcohol
Synonyms:
Benzenemethanol,4-bromo-;Benzyl alcohol,p-bromo-;4-Bromobenzenemethanol;p-Bromobenzyl alcohol;4-Bromobenzyl alcohol;(p-Bromophenyl)methanol;(4-Bromophenyl)methanol;4-Hydroxymethyl-1-bromobenzene;1-(p-Bromophenyl)methanol;1-Bromo-4-(hydroxymethyl)benzene
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Description

WHITE TO SLIGHTLY BEIGE CRYSTALS OR CRYST. POWDER

4-Bromobenzyl alcohol Basic Attributes

Molecular Weight：

187.03

Exact Mass：

187.03

EC Number：

212-851-7

DSSTox ID：

DTXSID50236276

HScode：

2906299090

Characteristics

PSA：

20.2

XLogP3：

Density：

1.565 g/cm3

Melting Point：

76.5-77.0 °C

Boiling Point：

125-140 °C @ Press: 11 Torr

Flash Point：

115.7ºC

Refractive Index：

1.591

Water Solubility：

2200 mg/L (at 20 °C)

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

R36/37/38

safety instructions：

S24/25

Marks：

Xi: Irritant;

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (42.86%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 7 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

4-bromobenzyl alcohol

Computed Properties

Molecular Weight:187.03
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:185.96803
Monoisotopic Mass:185.96803
Topological Polar Surface Area:20.2
Heavy Atom Count:9
Complexity:77
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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4-Bromobenzyl alcohol

CAS No.: 873-75-6

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