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1150271-25-2 | 5-Oxazolecarboxylic acid, 2,3-dihydro-2-oxo-, ethyl ester
CAS No: 1150271-25-2 Catalog No: AG000FP0 MDL No:MFCD12026055
Product Description
Catalog Number:
AG000FP0
Chemical Name:
5-Oxazolecarboxylic acid, 2,3-dihydro-2-oxo-, ethyl ester
CAS Number:
1150271-25-2
Molecular Formula:
C6H7NO4
Molecular Weight:
157.1241
MDL Number:
MFCD12026055
IUPAC Name:
ethyl 2-oxo-3H-1,3-oxazole-5-carboxylate
InChI:
InChI=1S/C6H7NO4/c1-2-10-5(8)4-3-7-6(9)11-4/h3H,2H2,1H3,(H,7,9)
InChI Key:
YUSJWUKJHXGPQN-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c[nH]c(=O)o1
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.038g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
157.125g/mol
Monoisotopic Mass:
157.038g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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