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4-acetyl-5-methylhexanenitrile

4-acetyl-5-methylhexanenitrile structure

CAS No:
34041-01-5
Formula:
C9H15NO
Chemical Name:
4-acetyl-5-methylhexanenitrile
Synonyms:
4-acetyl-5-methylhexanenitrile;34041-01-5;NSC134997;4-isopropyl-5-oxohexanenitrile;SCHEMBL9187234;4-Acetyl-5-methyl-hexanenitrile;DTXSID30300126;NSC-134997;DS-005259

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4-acetyl-5-methylhexanenitrile Basic Attributes

Molecular Weight：

153.22 g/mol

Exact Mass：

153.115364102 g/mol

NSC Number：

134997

DSSTox ID：

DTXSID30300126

Characteristics

PSA：

40.9 Å²

Computed Properties

Molecular Weight:153.22
XLogP3:1.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:153.115364102
Monoisotopic Mass:153.115364102
Topological Polar Surface Area:40.9
Heavy Atom Count:11
Complexity:175
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-acetyl-5-methylhexanenitrile

Basic Attributes
Characteristics
Computed Properties

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