5-Isoxazoleacetic acid, 4,5-dihydro-3-(4-hydroxyphenyl)-, methyl ester


Chemical Name: 5-Isoxazoleacetic acid, 4,5-dihydro-3-(4-hydroxyphenyl)-, methyl ester
CAS Number: 478336-92-4
Product Number: AG00DB6E(AGN-PC-0OAPUO)
Synonyms:
MDL No:
Molecular Formula: C12H13NO4
Molecular Weight: 235.2359

Identification/Properties


Properties
Storage:
Keep in dry area;-10 ℃;
Form:
Solid
Computed Properties
Molecular Weight:
235.239g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
235.084g/mol
Monoisotopic Mass:
235.084g/mol
Topological Polar Surface Area:
68.1A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
308
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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