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Home >> Chemical Listing >> Page 2862 >> 4-Chloro-2-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzonitrile

4-Chloro-2-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzonitrile
[CAS# 883898-93-9]

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Identification
Name 4-Chloro-2-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzonitrile
Synonyms 4-chloro-2-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzonitrile; 5-Chloro-2-cyanophenylboronic acid neopentyl glycol ester
Molecular Structure CAS#: 883898-93-9, 4-Chloro-2-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzonitrile
Molecular Formula C12H13BClNO2
Molecular Weight 249.50
CAS Registry Number 883898-93-9
SMILES Clc2cc(B1OCC(C)(C)CO1)c(C#N)cc2
InChI 1S/C12H13BClNO2/c1-12(2)7-16-13(17-8-12)11-5-10(14)4-3-9(11)6-15/h3-5H,7-8H2,1-2H3
InChIKey JUJHSJFBHCQGCU-UHFFFAOYSA-N
Properties
Density 1.193g/cm3 (Cal.)
Boiling point 394.981°C at 760 mmHg (Cal.)
Flash point 192.678°C (Cal.)
Refractive index 1.526 (Cal.)
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