Home Carboxys 5-Oxazolecarboxylicacid, 4-methyl-2-phenyl-, ethyl ester

5-Oxazolecarboxylicacid, 4-methyl-2-phenyl-, ethyl ester

CAS No.:
4620-52-4
Catalog Number:
AG006XAS
Molecular Formula:
C13H13NO3
Molecular Weight:
231.2472
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Product Description
Catalog Number:
AG006XAS
Chemical Name:
5-Oxazolecarboxylicacid, 4-methyl-2-phenyl-, ethyl ester
CAS Number:
4620-52-4
Molecular Formula:
C13H13NO3
Molecular Weight:
231.2472
MDL Number:
MFCD11055261
IUPAC Name:
ethyl 4-methyl-2-phenyl-1,3-oxazole-5-carboxylate
InChI:
InChI=1S/C13H13NO3/c1-3-16-13(15)11-9(2)14-12(17-11)10-7-5-4-6-8-10/h4-8H,3H2,1-2H3
InChI Key:
WDUXWFHGMSDULL-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1oc(nc1C)c1ccccc1
Properties
Complexity:
263  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.09g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.251g/mol
Monoisotopic Mass:
231.09g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties