sodium;4-ethoxycarbonyl-3-methyl-1,2-oxazol-5-olate;hydrate


Chemical Name: sodium;4-ethoxycarbonyl-3-methyl-1,2-oxazol-5-olate;hydrate
CAS Number: 207291-72-3
Product Number: AG00BH3D(AGN-PC-04778V)
Synonyms:
MDL No:
Molecular Formula: C7H10NNaO5
Molecular Weight: 211.14777

Identification/Properties


Computed Properties
Molecular Weight:
211.149g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
3
Exact Mass:
211.046g/mol
Monoisotopic Mass:
211.046g/mol
Topological Polar Surface Area:
76.4A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
178
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:
3
Compound Is Canonicalized:
Yes

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NMR Spectrum


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