Home Nitriles Propanenitrile,3-[(2,3-dimethylphenyl)amino]-

Propanenitrile,3-[(2,3-dimethylphenyl)amino]-

CAS No.:
36034-59-0
Catalog Number:
AG007CN0
Molecular Formula:
C11H14N2
Molecular Weight:
174.2423
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Product Description
Catalog Number:
AG007CN0
Chemical Name:
Propanenitrile,3-[(2,3-dimethylphenyl)amino]-
CAS Number:
36034-59-0
Molecular Formula:
C11H14N2
Molecular Weight:
174.2423
MDL Number:
MFCD04617224
IUPAC Name:
3-(2,3-dimethylanilino)propanenitrile
InChI:
InChI=1S/C11H14N2/c1-9-5-3-6-11(10(9)2)13-8-4-7-12/h3,5-6,13H,4,8H2,1-2H3
InChI Key:
XUIZSHFDUYDHSY-UHFFFAOYSA-N
SMILES:
Cc1c(NCCC#N)cccc1C
Properties
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.116g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
174.247g/mol
Monoisotopic Mass:
174.116g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties