Home Nitriles 4-[(benzyl)amino]butyronitrile monohydrochloride

4-[(benzyl)amino]butyronitrile monohydrochloride

CAS No.:
7544-97-0
Catalog Number:
AG00GCKP
Molecular Formula:
C11H15ClN2
Molecular Weight:
210.7032
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Product Description
Catalog Number:
AG00GCKP
Chemical Name:
4-[(benzyl)amino]butyronitrile monohydrochloride
CAS Number:
7544-97-0
Molecular Formula:
C11H15ClN2
Molecular Weight:
210.7032
MDL Number:
MFCD24843069
IUPAC Name:
4-(benzylamino)butanenitrile;hydrochloride
InChI:
InChI=1S/C11H14N2.ClH/c12-8-4-5-9-13-10-11-6-2-1-3-7-11;/h1-3,6-7,13H,4-5,9-10H2;1H
InChI Key:
MZJHLYULZSPGRX-UHFFFAOYSA-N
SMILES:
N#CCCCNCc1ccccc1.Cl
EC Number:
231-425-1
Properties
Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.092g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
210.705g/mol
Monoisotopic Mass:
210.092g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties