Teprene-3197-3

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Basic information

CAS: 90820-79-4
Standard SMILES: CC1=CCC(C)(C)C=CCC2(C)OC2CC1
InChIKey: QTGAEXCCAPTGLB-UHFFFAOYSA-N
Molecular formula: C15H24O
Average molar mass: 220.35 g/mol
Monoisotopic mass: 220.18271539

Overview

See also: Humulene epoxide II (annotation moved to); Humulene epoxide ii (-) (annotation moved to); Humulene oxide II (annotation moved to).

Names & identifiers

Preferred name: Teprene-3197-3
IUPAC: 1,5,5,8-tetramethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene

Names & synonyms

TEPRENE-3197-3DTXSID30877909RefChem:382870DTXCID901015974NOCAS_87790919888-34-790820-79-4Spectrum_000674SpecPlus_00065712-Oxabicyclo[9.1.0]dodeca-3,7-diene, 1,5,5,8-tetramethyl-Spectrum2_001763Spectrum3_001325

Show more names

Spectrum4_001453KBioGR_001965KBioSS_001154DivK1c_006753SPBio_001625SCHEMBL21824483KBio1_001697KBio2_001154

Database identifiers

CAS: 90820-79-4
PubChem CID: 524129
DTXSID: DTXSID00335248

Properties

Computed structural properties

XLogP: 3.8
Topological polar surface area: 12.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 0
Heavy atoms: 16
Formal charge: 0
Complexity: 324

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Compound notes

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