Home Nitriles 2-amino-2-(3,4,5-trimethoxyphenyl)acetonitrile hydrochloride

2-amino-2-(3,4,5-trimethoxyphenyl)acetonitrile hydrochloride

CAS No.:
348143-69-1
Catalog Number:
AG019N64
Molecular Formula:
C11H15ClN2O3
Molecular Weight:
258.7014
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Product Description
Catalog Number:
AG019N64
Chemical Name:
2-amino-2-(3,4,5-trimethoxyphenyl)acetonitrile hydrochloride
CAS Number:
348143-69-1
Molecular Formula:
C11H15ClN2O3
Molecular Weight:
258.7014
MDL Number:
MFCD11505455
IUPAC Name:
2-amino-2-(3,4,5-trimethoxyphenyl)acetonitrile;hydrochloride
InChI:
InChI=1S/C11H14N2O3.ClH/c1-14-9-4-7(8(13)6-12)5-10(15-2)11(9)16-3;/h4-5,8H,13H2,1-3H3;1H
InChI Key:
VATMLOCTTPDXIG-UHFFFAOYSA-N
SMILES:
N#CC(c1cc(OC)c(c(c1)OC)OC)N.Cl
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.077g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
258.702g/mol
Monoisotopic Mass:
258.077g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
77.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties