4-Oxazolecarboxylic acid, 5-methyl-2-phenyl-


Chemical Name: 4-Oxazolecarboxylic acid, 5-methyl-2-phenyl-
CAS Number: 18735-74-5
Product Number: AG007RY1(AGN-PC-0JOXIV)
Synonyms:
MDL No:
Molecular Formula: C11H9NO3
Molecular Weight: 203.1941

Identification/Properties


Computed Properties
Molecular Weight:
203.197g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
203.058g/mol
Monoisotopic Mass:
203.058g/mol
Topological Polar Surface Area:
63.3A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
238
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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