Home Nitriles 4-{[(2-methoxyethyl)amino]methyl}benzonitrile hydrochloride

4-{[(2-methoxyethyl)amino]methyl}benzonitrile hydrochloride

CAS No.:
1251923-40-6
Catalog Number:
AG01A9TH
Molecular Formula:
C11H15ClN2O
Molecular Weight:
226.7026
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Product Description
Catalog Number:
AG01A9TH
Chemical Name:
4-{[(2-methoxyethyl)amino]methyl}benzonitrile hydrochloride
CAS Number:
1251923-40-6
Molecular Formula:
C11H15ClN2O
Molecular Weight:
226.7026
MDL Number:
MFCD16817445
IUPAC Name:
4-[(2-methoxyethylamino)methyl]benzonitrile;hydrochloride
InChI:
InChI=1S/C11H14N2O.ClH/c1-14-7-6-13-9-11-4-2-10(8-12)3-5-11;/h2-5,13H,6-7,9H2,1H3;1H
InChI Key:
LFGYKTSBISCQTR-UHFFFAOYSA-N
SMILES:
COCCNCc1ccc(cc1)C#N.Cl
Properties
Complexity:
189  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.087g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
226.704g/mol
Monoisotopic Mass:
226.087g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
45A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties