1,2-oxazole-5-carboxylic acid

1,2-oxazole-5-carboxylic acid

CAS: 21169-71-1

Formula: C4H3NO3

SMILES: OC(=O)C1=CC=NO1

IUPAC: 1,2-oxazole-5-carboxylic acid

InChI: InChI=1S/C4H3NO3/c6-4(7)3-1-2-5-8-3/h1-2H,(H,6,7)

Composition: C (42.49%), H (2.67%), N (12.39%), O (42.45%)

Molar Mass: 113.072

Atom Count: 11

Heavy Atom Count: 8

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	113.011292961
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	MIIQJAUWHSUTIT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	24.63
Topological Polar Surface Area	63.33
Polarizability	8.88
Ring Count	1
Rotatable Bond Count	1

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