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Home > Indoles and Oxindole > 95958-02-4
95958-02-4 | 1H-Isoindole-1,3(2H)-dione, 2-(4,4-diphenyl-3-butenyl)-
CAS No: 95958-02-4 Catalog No: AG0069O7 MDL No:
Product Description
Catalog Number:
AG0069O7
Chemical Name:
1H-Isoindole-1,3(2H)-dione, 2-(4,4-diphenyl-3-butenyl)-
CAS Number:
95958-02-4
Molecular Formula:
C24H19NO2
Molecular Weight:
353.4132
IUPAC Name:
2-(4,4-diphenylbut-3-enyl)isoindole-1,3-dione
InChI:
InChI=1S/C24H19NO2/c26-23-21-14-7-8-15-22(21)24(27)25(23)17-9-16-20(18-10-3-1-4-11-18)19-12-5-2-6-13-19/h1-8,10-16H,9,17H2
InChI Key:
XHEUVZFFWMXCEM-UHFFFAOYSA-N
SMILES:
O=C1N(CCC=C(c2ccccc2)c2ccccc2)C(=O)c2c1cccc2
Properties
Complexity:
525
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.142g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
353.421g/mol
Monoisotopic Mass:
353.142g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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