4-(methoxymethyl)-5-methyl-1,2-oxazole-3-carboxylic acid

4-(methoxymethyl)-5-methyl-1,2-oxazole-3-carboxylic acid

CAS: 934156-84-0

Formula: C7H9NO4

SMILES: COCC1=C(C)ON=C1C(O)=O

IUPAC: 4-(methoxymethyl)-5-methyl-1,2-oxazole-3-carboxylic acid

InChI: InChI=1S/C7H9NO4/c1-4-5(3-11-2)6(7(9)10)8-12-4/h3H2,1-2H3,(H,9,10)

Composition: C (49.12%), H (5.30%), N (8.18%), O (37.39%)

Molar Mass: 171.152

Atom Count: 21

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	171.053157774
Formal Charge	0
FSP3	0.43
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	CRBKTECADDKUPY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	41.1
Topological Polar Surface Area	72.56
Polarizability	14.98
Ring Count	1
Rotatable Bond Count	3

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