Home Nitriles 3-(2-Aminoethyl)-benzonitrile hydrochloride

3-(2-Aminoethyl)-benzonitrile hydrochloride

CAS No.:
172348-36-6
Catalog Number:
AG00HZKS
Molecular Formula:
C9H11ClN2
Molecular Weight:
182.6500
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Product Description
Catalog Number:
AG00HZKS
Chemical Name:
3-(2-Aminoethyl)-benzonitrile hydrochloride
CAS Number:
172348-36-6
Molecular Formula:
C9H11ClN2
Molecular Weight:
182.6500
MDL Number:
MFCD21362292
IUPAC Name:
3-(2-aminoethyl)benzonitrile;hydrochloride
InChI:
InChI=1S/C9H10N2.ClH/c10-5-4-8-2-1-3-9(6-8)7-11;/h1-3,6H,4-5,10H2;1H
InChI Key:
PTBSBTYVOVWZAJ-UHFFFAOYSA-N
SMILES:
NCCc1cccc(c1)C#N.Cl
Properties
Complexity:
156  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.061g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
182.651g/mol
Monoisotopic Mass:
182.061g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties