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138369-76-3 | Pyrrolo[3,4-c]pyrrole-1,4-dione, 2,5-dihydro-2-methyl-3,6-diphenyl-
CAS No: 138369-76-3 Catalog No: AG0018N7 MDL No:
Product Description
Catalog Number:
AG0018N7
Chemical Name:
Pyrrolo[3,4-c]pyrrole-1,4-dione, 2,5-dihydro-2-methyl-3,6-diphenyl-
CAS Number:
138369-76-3
Molecular Formula:
C19H14N2O2
Molecular Weight:
302.3267
IUPAC Name:
6-hydroxy-5-methyl-1,4-diphenylpyrrolo[3,4-c]pyrrol-3-one
InChI:
InChI=1S/C19H14N2O2/c1-21-17(13-10-6-3-7-11-13)15-14(19(21)23)16(20-18(15)22)12-8-4-2-5-9-12/h2-11,23H,1H3
InChI Key:
FRDZQQLNHGNQRO-UHFFFAOYSA-N
SMILES:
Cn1c(c2ccccc2)c2c(c1=O)c([nH]c2=O)c1ccccc1
Properties
Complexity:
492
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.106g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
302.333g/mol
Monoisotopic Mass:
302.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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