Home Carboxys 2-Oxazolecarboxylic acid, 5-ethoxy-4-methyl-, ethyl ester

2-Oxazolecarboxylic acid, 5-ethoxy-4-methyl-, ethyl ester

CAS No.:
23429-04-1
Catalog Number:
AG00CC69
Molecular Formula:
C9H13NO4
Molecular Weight:
199.2038
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Product Description
Catalog Number:
AG00CC69
Chemical Name:
2-Oxazolecarboxylic acid, 5-ethoxy-4-methyl-, ethyl ester
CAS Number:
23429-04-1
Molecular Formula:
C9H13NO4
Molecular Weight:
199.2038
MDL Number:
MFCD01111980
IUPAC Name:
ethyl 5-ethoxy-4-methyl-1,3-oxazole-2-carboxylate
InChI:
InChI=1S/C9H13NO4/c1-4-12-8(11)7-10-6(3)9(14-7)13-5-2/h4-5H2,1-3H3
InChI Key:
PQRKGFMROBZFIM-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1nc(c(o1)OCC)C
Properties
Complexity:
197  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.084g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.206g/mol
Monoisotopic Mass:
199.084g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties