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83507-70-4 | Propanedioic acid, [[(4-methoxyphenyl)amino]methylene]-, diethyl ester
CAS No: 83507-70-4 Catalog No: AG00506P MDL No:MFCD00711864
Product Description
Catalog Number:
AG00506P
Chemical Name:
Propanedioic acid, [[(4-methoxyphenyl)amino]methylene]-, diethyl ester
CAS Number:
83507-70-4
Molecular Formula:
C15H19NO5
Molecular Weight:
293.3151
MDL Number:
MFCD00711864
IUPAC Name:
diethyl 2-[(4-methoxyanilino)methylidene]propanedioate
InChI:
InChI=1S/C15H19NO5/c1-4-20-14(17)13(15(18)21-5-2)10-16-11-6-8-12(19-3)9-7-11/h6-10,16H,4-5H2,1-3H3
InChI Key:
JBQNXIFJGSBDQB-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=CNc1ccc(cc1)OC)C(=O)OCC
Properties
Complexity:
352
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.126g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
293.319g/mol
Monoisotopic Mass:
293.126g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
73.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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