Home Nitriles 2-amino-2-ethyl-3-methylbutanenitrile

2-amino-2-ethyl-3-methylbutanenitrile

CAS No.:
1179705-68-0
Catalog Number:
AG01A6A0
Molecular Formula:
C7H14N2
Molecular Weight:
126.1995
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Product Description
Catalog Number:
AG01A6A0
Chemical Name:
2-amino-2-ethyl-3-methylbutanenitrile
CAS Number:
1179705-68-0
Molecular Formula:
C7H14N2
Molecular Weight:
126.1995
MDL Number:
MFCD12807216
IUPAC Name:
2-amino-2-ethyl-3-methylbutanenitrile
InChI:
InChI=1S/C7H14N2/c1-4-7(9,5-8)6(2)3/h6H,4,9H2,1-3H3
InChI Key:
JOAWGWIRTJDOPT-UHFFFAOYSA-N
SMILES:
CCC(C(C)C)(C#N)N
Properties
Complexity:
131  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.116g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
126.203g/mol
Monoisotopic Mass:
126.116g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties