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3-butyl-2,7-diazabicyclo[4.1.0]hept-4-ene-7-carbonitrile

3-butyl-2,7-diazabicyclo[4.1.0]hept-4-ene-7-carbonitrile structure

CAS No:
67334-83-2
Formula:
C10H15N3
Chemical Name:
3-butyl-2,7-diazabicyclo[4.1.0]hept-4-ene-7-carbonitrile
Synonyms:
67334-83-2;3-butyl-2,7-diazabicyclo[4.1.0]hept-4-ene-7-carbonitrile;NSC326639;DTXSID50318147;AKOS015907193;NSC-326639

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3-butyl-2,7-diazabicyclo[4.1.0]hept-4-ene-7-carbonitrile Basic Attributes

Molecular Weight：

177.25 g/mol

Exact Mass：

177.126597491 g/mol

NSC Number：

326639

DSSTox ID：

DTXSID50318147

Characteristics

PSA：

38.8 Å²

Computed Properties

Molecular Weight:177.25
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:177.126597491
Monoisotopic Mass:177.126597491
Topological Polar Surface Area:38.8
Heavy Atom Count:13
Complexity:263
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-butyl-2,7-diazabicyclo[4.1.0]hept-4-ene-7-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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