200,000+ products from a single source!
sales@angenechem.com
1454-12-2 | Propanedioic acid, 2-phenyl-2-(2-pyridinylmethyl)-, 1,3-diethyl ester, hydrochloride (1:1)
CAS No: 1454-12-2 Catalog No: AG001KVH MDL No:MFCD00110670
Product Description
Catalog Number:
AG001KVH
Chemical Name:
Propanedioic acid, 2-phenyl-2-(2-pyridinylmethyl)-, 1,3-diethyl ester, hydrochloride (1:1)
CAS Number:
1454-12-2
Molecular Formula:
C19H22ClNO4
Molecular Weight:
363.8353
MDL Number:
MFCD00110670
IUPAC Name:
diethyl 2-phenyl-2-(pyridin-2-ylmethyl)propanedioate;hydrochloride
InChI:
InChI=1S/C19H21NO4.ClH/c1-3-23-17(21)19(18(22)24-4-2,15-10-6-5-7-11-15)14-16-12-8-9-13-20-16;/h5-13H,3-4,14H2,1-2H3;1H
InChI Key:
WFPAMNMQXMJMLB-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(c1ccccc1)(C(=O)OCC)Cc1ccccn1.Cl
EC Number:
215-928-3
Properties
Complexity:
400
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
363.124g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
363.838g/mol
Monoisotopic Mass:
363.124g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
65.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.