200,000+ products from a single source!
sales@angenechem.com
19713-28-1 | Benzeneethanamine, N-[2-(3,4-dimethoxyphenyl)ethyl]-3,4-dimethoxy-, hydrochloride (1:1)
CAS No: 19713-28-1 Catalog No: AG002ALI MDL No:
Product Description
Catalog Number:
AG002ALI
Chemical Name:
Benzeneethanamine, N-[2-(3,4-dimethoxyphenyl)ethyl]-3,4-dimethoxy-, hydrochloride (1:1)
CAS Number:
19713-28-1
Molecular Formula:
C20H28ClNO4
Molecular Weight:
381.8936
IUPAC Name:
2-(3,4-dimethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]ethanamine;hydrochloride
InChI:
InChI=1S/C20H27NO4.ClH/c1-22-17-7-5-15(13-19(17)24-3)9-11-21-12-10-16-6-8-18(23-2)20(14-16)25-4;/h5-8,13-14,21H,9-12H2,1-4H3;1H
InChI Key:
PMKQAJYOSZNVAA-UHFFFAOYSA-N
SMILES:
COc1cc(CCNCCc2ccc(c(c2)OC)OC)ccc1OC.Cl
NSC Number:
243021
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
381.171g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
381.897g/mol
Monoisotopic Mass:
381.171g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
49A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.