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Benzal bromide

Benzal bromide structure

CAS No:
618-31-5
Formula:
C7H6Br2
Chemical Name:
Benzal bromide
Synonyms:
Benzene,(dibromomethyl)-;Toluene,α,α-dibromo-;(Dibromomethyl)benzene;Benzylidene bromide;Benzal bromide;Dibromophenylmethane;α,α-Dibromotoluene;Benzal dibromide;Benzylidene dibromide
Categories:
Organic Chemistry > Hydrocarbons and Derivatives

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Description

clear light yellow to orange liquid

Benzal bromide Basic Attributes

Molecular Weight：

249.93

Exact Mass：

249.93

EC Number：

210-543-7

HScode：

2903999090

Characteristics

PSA：

XLogP3：

3.47500

Density：

1.8555 g/cm³ @ Temp: 234 °C

Melting Point：

111 °C

Boiling Point：

116 °C @ Press: 12 Torr

Flash Point：

>230 °F

Refractive Index：

n20/D 1.614(lit.)

Safety Information

Packing level：

Hazard category：

6.1(a)

Transport codes：

UN 2927 6.1/PG 2

wgk germany：

hazard class code：

23/24/25-34

safety instructions：

23-26-36/37/39-45

Marks：

Precautionary statement(s)：

P261-P280-P301 + P310-P305 + P351 + P338-P310

Hazard Statements：

H301 + H311 + H331-H314

GHS Classification：

|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P260, P261, P264, P270, P271, P280, P301+P310, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P311, P312, P321, P322, P330, P361, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:249.93
XLogP3:3.4
Rotatable Bond Count:1
Exact Mass:249.88158
Monoisotopic Mass:247.88363
Heavy Atom Count:9
Complexity:75
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes