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67387-51-3

67387-51-3 | 4-Isoxazolecarboxamide, N-(4-hydroxyphenyl)-5-methyl-

CAS No: 67387-51-3 Catalog No: AG006HIP MDL No:

Product Description

Catalog Number:
AG006HIP
Chemical Name:
4-Isoxazolecarboxamide, N-(4-hydroxyphenyl)-5-methyl-
CAS Number:
67387-51-3
Molecular Formula:
C11H10N2O3
Molecular Weight:
218.2087
IUPAC Name:
N-(4-hydroxyphenyl)-5-methyl-1,2-oxazole-4-carboxamide
InChI:
InChI=1S/C11H10N2O3/c1-7-10(6-12-16-7)11(15)13-8-2-4-9(14)5-3-8/h2-6,14H,1H3,(H,13,15)
InChI Key:
UINQKGBHZHDNAC-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)NC(=O)c1cnoc1C

Properties

Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.069g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
218.212g/mol
Monoisotopic Mass:
218.069g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

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