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64384-94-7 | N-(3-hydroxyphenyl)-3-methyl-5-isoxazolecarboxamide
CAS No: 64384-94-7 Catalog No: AG00EC25 MDL No:MFCD08106053
Product Description
Catalog Number:
AG00EC25
Chemical Name:
N-(3-hydroxyphenyl)-3-methyl-5-isoxazolecarboxamide
CAS Number:
64384-94-7
Molecular Formula:
C11H10N2O3
Molecular Weight:
218.2087
MDL Number:
MFCD08106053
IUPAC Name:
N-(3-hydroxyphenyl)-3-methyl-1,2-oxazole-5-carboxamide
InChI:
InChI=1S/C11H10N2O3/c1-7-5-10(16-13-7)11(15)12-8-3-2-4-9(14)6-8/h2-6,14H,1H3,(H,12,15)
InChI Key:
YDKYDNXYHUEWEO-UHFFFAOYSA-N
SMILES:
Oc1cccc(c1)NC(=O)c1onc(c1)C
Properties
Complexity:
260
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:
1.6
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