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2-Bromobenzyl alcohol

2-Bromobenzyl alcohol structure

CAS No:
18982-54-2
Formula:
C7H7BrO
Chemical Name:
2-Bromobenzyl alcohol
Synonyms:
Benzenemethanol,2-bromo-;Benzyl alcohol,o-bromo-;2-Bromobenzenemethanol;o-Bromobenzyl alcohol;2-Bromobenzyl alcohol;1-Bromo-2-(hydroxymethyl)benzene;2-Bromophenylmethanol;2-Hydroxymethyl-1-bromobenzene;2-(Hydroxymethyl)phenyl bromide;185532-98-3
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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2-Bromobenzyl alcohol Basic Attributes

Molecular Weight：

187.03400

Exact Mass：

187.03

EC Number：

242-719-4

UNII：

XH9B68J1KG

DSSTox ID：

DTXSID80172411

HScode：

29062900

Characteristics

PSA：

20.23000

XLogP3：

1.94140

Appearance：

white crystal

Density：

1.565 g/cm3

Melting Point：

79 °C

Boiling Point：

261.8ºC at 760 mmHg

Flash Point：

112.1ºC

Refractive Index：

1.591

Water Solubility：

0.01 M

Storage Conditions：

Store at RT.

Vapor Pressure：

0.00572mmHg at 25°C

Safety Information

wgk germany：

safety instructions：

S24/25

Marks：

Stability/Shelf Life：

Stable under normal temperatures and pressures.

GHS Classification：

|Warning|H302 (95.12%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501|Aggregated GHS information provided by 41 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:187.03
XLogP3:1.9
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:85
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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2-Bromobenzyl alcohol

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