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3532-75-0 | 3-hydroxy-3-phenyl-2-(prop-2-en-1-yl)-2,3-dihydro-1h-isoindol-1-one
CAS No: 3532-75-0 Catalog No: AG007DP9 MDL No:
Product Description
Catalog Number:
AG007DP9
Chemical Name:
3-hydroxy-3-phenyl-2-(prop-2-en-1-yl)-2,3-dihydro-1h-isoindol-1-one
CAS Number:
3532-75-0
Molecular Formula:
C17H15NO2
Molecular Weight:
265.3065
IUPAC Name:
3-hydroxy-3-phenyl-2-prop-2-enylisoindol-1-one
InChI:
InChI=1S/C17H15NO2/c1-2-12-18-16(19)14-10-6-7-11-15(14)17(18,20)13-8-4-3-5-9-13/h2-11,20H,1,12H2
InChI Key:
PXEQOBXIAQEZNQ-UHFFFAOYSA-N
SMILES:
C=CCN1C(=O)c2c(C1(O)c1ccccc1)cccc2
NSC Number:
67326
Properties
Complexity:
389
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.11g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
265.312g/mol
Monoisotopic Mass:
265.11g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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