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185337-43-3

185337-43-3 | 3(2H)-Isoxazolone, 5-hydroxy-4-[2-[(2-methylphenoxy)methyl]phenyl]-

CAS No: 185337-43-3 Catalog No: AG0077FO MDL No:

Product Description

Catalog Number:
AG0077FO
Chemical Name:
3(2H)-Isoxazolone, 5-hydroxy-4-[2-[(2-methylphenoxy)methyl]phenyl]-
CAS Number:
185337-43-3
Molecular Formula:
C17H15NO4
Molecular Weight:
297.3053
IUPAC Name:
5-hydroxy-4-[2-[(2-methylphenoxy)methyl]phenyl]-1,2-oxazol-3-one
InChI:
InChI=1S/C17H15NO4/c1-11-6-2-5-9-14(11)21-10-12-7-3-4-8-13(12)15-16(19)18-22-17(15)20/h2-9,20H,10H2,1H3,(H,18,19)
InChI Key:
QVTRTBPYOXGFLX-UHFFFAOYSA-N
SMILES:
Cc1ccccc1OCc1ccccc1c1c(O)o[nH]c1=O

Properties

Complexity:
448  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.1g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
297.31g/mol
Monoisotopic Mass:
297.1g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
67.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

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