Home Nitriles 3-[(2-ethylbutyl)amino]propanenitrile

3-[(2-ethylbutyl)amino]propanenitrile

CAS No.:
1042524-46-8
Catalog Number:
AG01AB24
Molecular Formula:
C9H18N2
Molecular Weight:
154.2526
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Product Description
Catalog Number:
AG01AB24
Chemical Name:
3-[(2-ethylbutyl)amino]propanenitrile
CAS Number:
1042524-46-8
Molecular Formula:
C9H18N2
Molecular Weight:
154.2526
MDL Number:
MFCD11166641
IUPAC Name:
3-(2-ethylbutylamino)propanenitrile
InChI:
InChI=1S/C9H18N2/c1-3-9(4-2)8-11-7-5-6-10/h9,11H,3-5,7-8H2,1-2H3
InChI Key:
JUMZVQOZMJFHKA-UHFFFAOYSA-N
SMILES:
CCC(CNCCC#N)CC
Properties
Complexity:
119  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.147g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
154.257g/mol
Monoisotopic Mass:
154.147g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties