Home Nitriles 3-(2-aminoethyl)benzonitrile

3-(2-aminoethyl)benzonitrile

CAS No.:
219919-49-0
Catalog Number:
AG01B7XD
Molecular Formula:
C9H10N2
Molecular Weight:
146.1891
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Product Description
Catalog Number:
AG01B7XD
Chemical Name:
3-(2-aminoethyl)benzonitrile
CAS Number:
219919-49-0
Molecular Formula:
C9H10N2
Molecular Weight:
146.1891
MDL Number:
MFCD19207366
IUPAC Name:
3-(2-aminoethyl)benzonitrile
InChI:
InChI=1S/C9H10N2/c10-5-4-8-2-1-3-9(6-8)7-11/h1-3,6H,4-5,10H2
InChI Key:
JSHAWLCRADHRGW-UHFFFAOYSA-N
SMILES:
NCCc1cccc(c1)C#N
Properties
Complexity:
156  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.084g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
146.193g/mol
Monoisotopic Mass:
146.084g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties