Home Nitriles 3-(2-aminopropan-2-yl)benzonitrile hydrochloride

3-(2-aminopropan-2-yl)benzonitrile hydrochloride

CAS No.:
1909337-24-1
Catalog Number:
AG01C6HC
Molecular Formula:
C10H13ClN2
Molecular Weight:
196.6766
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Product Description
Catalog Number:
AG01C6HC
Chemical Name:
3-(2-aminopropan-2-yl)benzonitrile hydrochloride
CAS Number:
1909337-24-1
Molecular Formula:
C10H13ClN2
Molecular Weight:
196.6766
MDL Number:
MFCD29907123
IUPAC Name:
3-(2-aminopropan-2-yl)benzonitrile;hydrochloride
InChI:
InChI=1S/C10H12N2.ClH/c1-10(2,12)9-5-3-4-8(6-9)7-11;/h3-6H,12H2,1-2H3;1H
InChI Key:
HKASVMDOASEUHB-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(c1)C(N)(C)C.Cl
Properties
Complexity:
199  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.077g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
196.678g/mol
Monoisotopic Mass:
196.077g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties