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2863-94-7 | 2-Propenoic acid, 3-[4-[(E)-[(4-ethoxyphenyl)methylene]amino]phenyl]-, ethyl ester, (2E)-
CAS No: 2863-94-7 Catalog No: AG002VWP MDL No:
Product Description
Catalog Number:
AG002VWP
Chemical Name:
2-Propenoic acid, 3-[4-[(E)-[(4-ethoxyphenyl)methylene]amino]phenyl]-, ethyl ester, (2E)-
CAS Number:
2863-94-7
Molecular Formula:
C20H21NO3
Molecular Weight:
323.3856
IUPAC Name:
ethyl (E)-3-[4-[(4-ethoxyphenyl)methylideneamino]phenyl]prop-2-enoate
InChI:
InChI=1S/C20H21NO3/c1-3-23-19-12-7-17(8-13-19)15-21-18-10-5-16(6-11-18)9-14-20(22)24-4-2/h5-15H,3-4H2,1-2H3/b14-9+,21-15?
InChI Key:
CVVDLYBLLWQIDB-BAAZBEGMSA-N
SMILES:
CCOC(=O)/C=C/c1ccc(cc1)/N=C/c1ccc(cc1)OCC
EC Number:
220-683-0
Properties
Complexity:
417
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
323.152g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
323.392g/mol
Monoisotopic Mass:
323.152g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
47.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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