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4-BROMO-2-(5,5-DIMETHYL-1,3,2-DIOXABORINAN-2-YL)BENZONITRILE

4-BROMO-2-(5,5-DIMETHYL-1,3,2-DIOXABORINAN-2-YL)BENZONITRILE structure

CAS No:
883898-95-1
Formula:
C12H13BBrNO2
Chemical Name:
4-BROMO-2-(5,5-DIMETHYL-1,3,2-DIOXABORINAN-2-YL)BENZONITRILE
Synonyms:
4-bromo-2-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzonitrile;ZINC196169994;2-(5,5-Dimethyldihydro-4H-1,3,2-dioxaborin-2-yl)-4-bromobenzonitrile

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Description

White crystal

4-BROMO-2-(5,5-DIMETHYL-1,3,2-DIOXABORINAN-2-YL)BENZONITRILE Basic Attributes

Molecular Weight：

293.95212

Exact Mass：

293.022

HScode：

29269090

Characteristics

PSA：

42.2

XLogP3：

0.00000

Safety Information

hazard class code：

20/21/22

safety instructions：

36/37-24/25

Computed Properties

Molecular Weight:293.95
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:293.02227
Monoisotopic Mass:293.02227
Topological Polar Surface Area:42.2
Heavy Atom Count:17
Complexity:318
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-BROMO-2-(5,5-DIMETHYL-1,3,2-DIOXABORINAN-2-YL)BENZONITRILE

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties

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