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89543-34-0 | 1H-Pyrrole-2,5-dione, 1-(4-methoxyphenyl)-3-(2-propenylamino)-
CAS No: 89543-34-0 Catalog No: AG003YLG MDL No:
Product Description
Catalog Number:
AG003YLG
Chemical Name:
1H-Pyrrole-2,5-dione, 1-(4-methoxyphenyl)-3-(2-propenylamino)-
CAS Number:
89543-34-0
Molecular Formula:
C14H14N2O3
Molecular Weight:
258.2726
IUPAC Name:
1-(4-methoxyphenyl)-3-(prop-2-enylamino)pyrrole-2,5-dione
InChI:
InChI=1S/C14H14N2O3/c1-3-8-15-12-9-13(17)16(14(12)18)10-4-6-11(19-2)7-5-10/h3-7,9,15H,1,8H2,2H3
InChI Key:
PPYVEJJLKROASD-UHFFFAOYSA-N
SMILES:
C=CCNC1=CC(=O)N(C1=O)c1ccc(cc1)OC
Properties
Complexity:
409
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.1g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
258.277g/mol
Monoisotopic Mass:
258.1g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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