Home Aminos N-(1-amino-3-methylbutan-2-yl)aniline

N-(1-amino-3-methylbutan-2-yl)aniline

CAS No.:
929973-60-4
Catalog Number:
AG019KKN
Molecular Formula:
C11H18N2
Molecular Weight:
178.2740
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Product Description
Catalog Number:
AG019KKN
Chemical Name:
N-(1-amino-3-methylbutan-2-yl)aniline
CAS Number:
929973-60-4
Molecular Formula:
C11H18N2
Molecular Weight:
178.2740
MDL Number:
MFCD09040578
IUPAC Name:
3-methyl-2-N-phenylbutane-1,2-diamine
InChI:
InChI=1S/C11H18N2/c1-9(2)11(8-12)13-10-6-4-3-5-7-10/h3-7,9,11,13H,8,12H2,1-2H3
InChI Key:
AMOLXIHWDNPJRW-UHFFFAOYSA-N
SMILES:
NCC(C(C)C)Nc1ccccc1
Properties
Complexity:
128  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.147g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
178.279g/mol
Monoisotopic Mass:
178.147g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties