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Home > Indoles and Oxindole > 19357-24-5
19357-24-5 | 1H-Isoindole-1,3(2H)-dione, 2-(4-phenoxyphenyl)-
CAS No: 19357-24-5 Catalog No: AG007321 MDL No:
Product Description
Catalog Number:
AG007321
Chemical Name:
1H-Isoindole-1,3(2H)-dione, 2-(4-phenoxyphenyl)-
CAS Number:
19357-24-5
Molecular Formula:
C20H13NO3
Molecular Weight:
315.3221
IUPAC Name:
2-(4-phenoxyphenyl)isoindole-1,3-dione
InChI:
InChI=1S/C20H13NO3/c22-19-17-8-4-5-9-18(17)20(23)21(19)14-10-12-16(13-11-14)24-15-6-2-1-3-7-15/h1-13H
InChI Key:
ATQNCYZXYKKCSS-UHFFFAOYSA-N
SMILES:
O=C1N(c2ccc(cc2)Oc2ccccc2)C(=O)c2c1cccc2
Properties
Complexity:
453
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.09g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
315.328g/mol
Monoisotopic Mass:
315.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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