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3-BROMO-4,5-DIMETHOXY-BENZONITRILE

3-BROMO-4,5-DIMETHOXY-BENZONITRILE structure

CAS No:
781654-31-7
Formula:
C9H8BrNO2
Chemical Name:
3-BROMO-4,5-DIMETHOXY-BENZONITRILE
Synonyms:
3-bromo-4,5-dimethoxybenzonitrile;F3099-6742;3-bromo-4,5-dimethoxybenzenecarbonitrile;3-BROMO-4,5-DIMETHOXY-BENZONITRILE;ACMC-1BL8U;SCHEMBL523635;CTK5E5465;DTXSID30352802;3-bromo-4,5 dimethoxybenzonitrile;ZINC151906

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3-BROMO-4,5-DIMETHOXY-BENZONITRILE Basic Attributes

Molecular Weight：

242.07

Exact Mass：

240.97400

DSSTox ID：

DTXSID30352802

HScode：

2926909090

Characteristics

PSA：

42.2

XLogP3：

2.33798

Density：

1.53g/cm3

Boiling Point：

291.1ºC at 760 mmHg

Flash Point：

129.9ºC

Refractive Index：

1.569

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

UN3439

Computed Properties

Molecular Weight:242.07
XLogP3:2.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:240.97384
Monoisotopic Mass:240.97384
Topological Polar Surface Area:42.2
Heavy Atom Count:13
Complexity:213
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-BROMO-4,5-DIMETHOXY-BENZONITRILE

Basic Attributes
Characteristics
Safety Information
Computed Properties

3-BROMO-4,5-DIMETHOXY-BENZONITRILE

SDS

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