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18167-15-2

18167-15-2 | 1H-Isoindol-1-one, 2,3-dihydro-3-hydroxy-2-phenyl-

CAS No: 18167-15-2 Catalog No: AG00230M MDL No:

Product Description

Catalog Number:
AG00230M
Chemical Name:
1H-Isoindol-1-one, 2,3-dihydro-3-hydroxy-2-phenyl-
CAS Number:
18167-15-2
Molecular Formula:
C14H11NO2
Molecular Weight:
225.2426
IUPAC Name:
3-hydroxy-2-phenyl-3H-isoindol-1-one
InChI:
InChI=1S/C14H11NO2/c16-13-11-8-4-5-9-12(11)14(17)15(13)10-6-2-1-3-7-10/h1-9,13,16H
InChI Key:
ZLODOCHSFJATAJ-UHFFFAOYSA-N
SMILES:
O=C1c2ccccc2C(N1c1ccccc1)O
EC Number:
242-051-3
NSC Number:
114249

Properties

Complexity:
299  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.079g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
225.247g/mol
Monoisotopic Mass:
225.079g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

Literature

Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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