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3-(BROMOMETHYL)-4-FLUOROBENZONITRILE

3-(BROMOMETHYL)-4-FLUOROBENZONITRILE structure

CAS No:
856935-35-8
Formula:
C8H5BrFN
Chemical Name:
3-(BROMOMETHYL)-4-FLUOROBENZONITRILE
Synonyms:
3-(bromomethyl)-4-fluorobenzonitrile;BENZONITRILE, 3-(BROMOMETHYL)-4-FLUORO-;Benzonitrile,3-(bromomethyl)-4-fluoro-;SCHEMBL411021;2-fluoro-5-cyanobenzyl bromide;CTK5F5524;DTXSID70585394;KS-00000D3O;ZINC9579629;3-Bromomethyl-4-fluoro-benzonitrile

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3-(BROMOMETHYL)-4-FLUOROBENZONITRILE Basic Attributes

Molecular Weight：

214.03

Exact Mass：

212.95900

DSSTox ID：

DTXSID70585394

Characteristics

PSA：

23.8

XLogP3：

2.59228

Density：

1.591g/cm3

Boiling Point：

274.389ºC at 760 mmHg

Flash Point：

119.747ºC

Refractive Index：

1.564

Safety Information

GHS Classification：

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P363, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:214.03
XLogP3:2.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:212.95894
Monoisotopic Mass:212.95894
Topological Polar Surface Area:23.8
Heavy Atom Count:11
Complexity:174
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(BROMOMETHYL)-4-FLUOROBENZONITRILE

Basic Attributes
Characteristics
Safety Information
Computed Properties

3-(BROMOMETHYL)-4-FLUOROBENZONITRILE

SDS

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