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296770-21-3

296770-21-3 | 4-(1,3-Dihydro-isoindol-2-yl)-2-hydroxy-benzoic acid

CAS No: 296770-21-3 Catalog No: AG00I5HQ MDL No:MFCD00755023

Product Description

Catalog Number:
AG00I5HQ
Chemical Name:
4-(1,3-Dihydro-isoindol-2-yl)-2-hydroxy-benzoic acid
CAS Number:
296770-21-3
Molecular Formula:
C15H13NO3
Molecular Weight:
255.2686
MDL Number:
MFCD00755023
IUPAC Name:
4-(1,3-dihydroisoindol-2-yl)-2-hydroxybenzoic acid
InChI:
InChI=1S/C15H13NO3/c17-14-7-12(5-6-13(14)15(18)19)16-8-10-3-1-2-4-11(10)9-16/h1-7,17H,8-9H2,(H,18,19)
InChI Key:
DFOUMKWDEKEKKG-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1O)N1Cc2c(C1)cccc2

Properties

Complexity:
332  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.09g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
255.273g/mol
Monoisotopic Mass:
255.09g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
60.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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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