3-Oxatricyclo[3.2.1.02,4]oct-6-ene

HCID 255191

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Basic information

CAS: 6931-50-6
Standard SMILES: C1=CC2CC1C1OC21
InChIKey: YORASZMZQNWVEF-UHFFFAOYSA-N
Molecular formula: C7H8O
Average molar mass: 108.14 g/mol
Monoisotopic mass: 108.05751487

Names & identifiers

Preferred name: 3-Oxatricyclo[3.2.1.02,4]oct-6-ene
IUPAC: 3-oxatricyclo[3.2.1.02,4]oct-6-ene

Names & synonyms

6931-50-63-oxatricyclo[3.2.1.02,4]oct-6-eneNSC80506Norbornene, 4,5-epoxySCHEMBL2250610DTXSID20292142YORASZMZQNWVEF-UHFFFAOYSA-NNSC-805063-Oxatricyclo[3.2.1.0~2,4~]oct-6-ene

Database identifiers

CAS: 6931-50-6
PubChem CID: 255191
DTXSID: DTXSID20292142

Properties

Computed structural properties

XLogP: 0.9
Topological polar surface area: 12.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 0
Heavy atoms: 8
Formal charge: 0
Complexity: 146

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