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1014645-75-0 | 4-(1-Aminocyclopropyl)benzonitrile
CAS No: 1014645-75-0 Catalog No: AG0004JD MDL No:MFCD11616338
Product Description
Catalog Number:
AG0004JD
Chemical Name:
4-(1-Aminocyclopropyl)benzonitrile
CAS Number:
1014645-75-0
Molecular Formula:
C10H10N2
Molecular Weight:
158.1998
MDL Number:
MFCD11616338
IUPAC Name:
4-(1-aminocyclopropyl)benzonitrile
InChI:
InChI=1S/C10H10N2/c11-7-8-1-3-9(4-2-8)10(12)5-6-10/h1-4H,5-6,12H2
InChI Key:
GRTUEBYYYFNVJY-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)C1(N)CC1
Properties
Complexity:
213
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:
1
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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