Benzonitrile, 5-amino-2-(1-pyrrolidinyl)-


Chemical Name: Benzonitrile, 5-amino-2-(1-pyrrolidinyl)-
CAS Number: 219921-68-3
Product Number: AG00C21S(AGN-PC-0N9XH8)
Synonyms:
MDL No:
Molecular Formula: C11H13N3
Molecular Weight: 187.2410

Identification/Properties


Computed Properties
Molecular Weight:
187.246g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
187.111g/mol
Monoisotopic Mass:
187.111g/mol
Topological Polar Surface Area:
53A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
236
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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