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6-oxo-7-oxa-5-azaspiro[3.4]octane-2-carboxylic acid

6-oxo-7-oxa-5-azaspiro[3.4]octane-2-carboxylic acid

Formula: C7H9NO4

SMILES: OC(=O)C1CC2(C1)COC(=O)N2

IUPAC: 6-oxo-7-oxa-5-azaspiro[3.4]octane-2-carboxylic acid

InChI: InChI=1S/C7H9NO4/c9-5(10)4-1-7(2-4)3-12-6(11)8-7/h4H,1-3H2,(H,8,11)(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 0
Asymmetric Atom Count 0
Exact Mass 171.053157774
Formal Charge 0
FSP3 0.71
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey IGXPOTLWCQJQJQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 36.96
Topological Polar Surface Area 75.63
Polarizability 14.79
Ring Count 2
Rotatable Bond Count 1

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