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1019607-55-6 | Benzonitrile, 4-(cyclopropylamino)-
CAS No: 1019607-55-6 Catalog No: AG00063T MDL No:MFCD11135501
Product Description
Catalog Number:
AG00063T
Chemical Name:
Benzonitrile, 4-(cyclopropylamino)-
CAS Number:
1019607-55-6
Molecular Formula:
C10H10N2
Molecular Weight:
158.1998
MDL Number:
MFCD11135501
IUPAC Name:
4-(cyclopropylamino)benzonitrile
InChI:
InChI=1S/C10H10N2/c11-7-8-1-3-9(4-2-8)12-10-5-6-10/h1-4,10,12H,5-6H2
InChI Key:
SHZXUUVOVQTNCK-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)NC1CC1
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
158.204g/mol
Monoisotopic Mass:
158.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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