4-Hydroxy-8-isocyano-1-oxaspiro[4.4]non-6-en-2-one

AlkaPlorer ID: AK301308

Synonym: None

IUPAC Name: 4-hydroxy-8-isocyano-1-oxaspiro[4.4]non-8-en-2-one

Structure

SMILES: [C-]#[N+]C1=CC2(CC1)OC(=O)CC2O

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InChI: InChI=1S/C9H9NO3/c1-10-6-2-3-9(5-6)7(11)4-8(12)13-9/h5,7,11H,2-4H2

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InChIKey: DPJFGDYOPUQBAY-UHFFFAOYSA-N

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Reference

PubChem CID: 85615727

CAS: 136314-48-2

Properties Information

Molecule Weight: 179.17499999999998

TPSA: 50.89

MolLogP: 0.62999

Number of H-Donors: 1

Number of H-Acceptors: 3

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information