2,3,3a,7a-tetrahydro-1,3-benzoxazol-2-one

AlkaPlorer ID: AK044818

Synonym: None

IUPAC Name: 3a,7a-dihydro-3H-1,3-benzoxazol-2-one

Structure

SMILES: OC1=NC2C=CC=CC2O1

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InChI: InChI=1S/C7H7NO2/c9-7-8-5-3-1-2-4-6(5)10-7/h1-6H,(H,8,9)

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InChIKey: ATTNBXYKQKMCNP-UHFFFAOYSA-N

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Reference

PubChem CID: 23016507

CAS: 59-49-4

NPASS: NPC37430

COCONUT: CNP0086322

Source

Species Genus Family Order Class Phylum Kingdom Domain
Acanthus ilicifolius Acanthus Acanthaceae Lamiales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 137.13799999999998

TPSA: 41.82000000000001

MolLogP: 0.7938000000000001

Number of H-Donors: 1

Number of H-Acceptors: 2

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information