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2-hydroxy-3-methylbutanenitrile

2-hydroxy-3-methylbutanenitrile structure

CAS No:
15344-34-0
Formula:
C5H9NO
Chemical Name:
2-hydroxy-3-methylbutanenitrile
Synonyms:
2-Hydroxy-3-methyl-butyronitril; BUTANENITRILE,2-HYDROXY-3-METHYL;

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2-hydroxy-3-methylbutanenitrile Basic Attributes

Molecular Weight：

99.13110

Exact Mass：

99.068413911

HScode：

2926909090

Characteristics

PSA：

44.02000

XLogP3：

0.52688

Density：

0.965g/cm3

Boiling Point：

197.265ºC

Flash Point：

73.103ºC

Refractive Index：

1.431

Vapor Pressure：

0.098mmHg at 25°C

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, 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:99.13
XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:99.068413911
Monoisotopic Mass:99.068413911
Topological Polar Surface Area:44
Heavy Atom Count:7
Complexity:89.5
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-hydroxy-3-methylbutanenitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties

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