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2-METHYLHEPTANENITRILE

2-METHYLHEPTANENITRILE structure

CAS No:
54321-41-4
Formula:
C8H15N
Chemical Name:
2-METHYLHEPTANENITRILE
Synonyms:
2-cyanoheptane; Heptane,2-cyano; 1-HEPTANENITRILE,2-METHYL; 2-methyl-Heptanenitrile; 2-Methylheptylnitril; 2-Methylheptanonitrile;Expand

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2-METHYLHEPTANENITRILE Basic Attributes

Molecular Weight：

125.21100

Exact Mass：

125.120449483 g/mol

HScode：

2926909090

Characteristics

PSA：

23.79000

XLogP3：

2.72638

Density：

0.811g/cm3

Boiling Point：

193ºC

Flash Point：

82.3ºC

Refractive Index：

1.419

Computed Properties

Molecular Weight:125.21
XLogP3:3
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:125.120449483
Monoisotopic Mass:125.120449483
Topological Polar Surface Area:23.8
Heavy Atom Count:9
Complexity:98.4
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-METHYLHEPTANENITRILE

Basic Attributes
Characteristics
Computed Properties

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