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3-(propylaminomethyl)benzonitrile

3-(propylaminomethyl)benzonitrile structure

CAS No:
90389-98-3
Formula:
C11H14N2
Chemical Name:
3-(propylaminomethyl)benzonitrile
Synonyms:
90389-98-3;Benzonitrile, 3-((propylamino)methyl)-;Benzonitrile, 3-[(propylamino)methyl]-;3-(propylaminomethyl)benzonitrile;CHEMBL1178176;DTXSID80238127;ZINC6380492;AKOS000176086;90389-64-3

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3-(propylaminomethyl)benzonitrile Basic Attributes

Molecular Weight：

174.24 g/mol

Exact Mass：

174.115698455 g/mol

DSSTox ID：

DTXSID80238127

Characteristics

PSA：

35.8 Å²

Computed Properties

Molecular Weight:174.24
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:174.115698455
Monoisotopic Mass:174.115698455
Topological Polar Surface Area:35.8
Heavy Atom Count:13
Complexity:180
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(propylaminomethyl)benzonitrile

Basic Attributes
Characteristics
Computed Properties

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