methyl 1,3-oxazole-2-carboxylate

methyl 1,3-oxazole-2-carboxylate

CAS: 31698-88-1

Formula: C5H5NO3

SMILES: COC(=O)C1=NC=CO1

IUPAC: methyl 1,3-oxazole-2-carboxylate

InChI: InChI=1S/C5H5NO3/c1-8-5(7)4-6-2-3-9-4/h2-3H,1H3

Composition: C (47.25%), H (3.97%), N (11.02%), O (37.76%)

Molar Mass: 127.099

Atom Count: 14

Heavy Atom Count: 9

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	127.026943025
Formal Charge	0
FSP3	0.2
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	GSKQTLDIWHGWSR-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	28.27
Topological Polar Surface Area	52.33
Polarizability	10.89
Ring Count	1
Rotatable Bond Count	2

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