Home Nitriles 3-[(3-methylbutyl)amino]propanenitrile

3-[(3-methylbutyl)amino]propanenitrile

CAS No.:
927385-48-6
Catalog Number:
AG01AAOS
Molecular Formula:
C8H16N2
Molecular Weight:
140.2260
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Product Description
Catalog Number:
AG01AAOS
Chemical Name:
3-[(3-methylbutyl)amino]propanenitrile
CAS Number:
927385-48-6
Molecular Formula:
C8H16N2
Molecular Weight:
140.2260
MDL Number:
MFCD11166644
IUPAC Name:
3-(3-methylbutylamino)propanenitrile
InChI:
InChI=1S/C8H16N2/c1-8(2)4-7-10-6-3-5-9/h8,10H,3-4,6-7H2,1-2H3
InChI Key:
BHLQPHRYYFPHQJ-UHFFFAOYSA-N
SMILES:
N#CCCNCCC(C)C
Properties
Complexity:
110  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.131g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
140.23g/mol
Monoisotopic Mass:
140.131g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties