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10351-59-4 | Benzaldehyde,2-[(2,5-dihydro-2,5-dioxo-1-phenyl-1H-pyrrol-3-yl)amino]-
CAS No: 10351-59-4 Catalog No: AG0085ND MDL No:
Product Description
Catalog Number:
AG0085ND
Chemical Name:
Benzaldehyde,2-[(2,5-dihydro-2,5-dioxo-1-phenyl-1H-pyrrol-3-yl)amino]-
CAS Number:
10351-59-4
Molecular Formula:
C17H12N2O3
Molecular Weight:
292.2888
IUPAC Name:
2-[(2,5-dioxo-1-phenylpyrrol-3-yl)amino]benzaldehyde
InChI:
InChI=1S/C17H12N2O3/c20-11-12-6-4-5-9-14(12)18-15-10-16(21)19(17(15)22)13-7-2-1-3-8-13/h1-11,18H
InChI Key:
MCSMBSOMRCYNSD-UHFFFAOYSA-N
SMILES:
O=Cc1ccccc1NC1=CC(=O)N(C1=O)c1ccccc1
NSC Number:
99416
Properties
Complexity:
494
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.085g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
292.294g/mol
Monoisotopic Mass:
292.085g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
66.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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