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Chemical structure of (-)-Bornyl acetate

GC26688

(-)-Bornyl acetate

Also known as [(1S,2R,4S)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] acetate

(-)-Bornyl acetate (L-(-)-Bornyl acetate), isolated from hyssop oil, is a less active enantiomer of (+)-Bornyl acetate· (-)-Bornyl acetate possesses antifungal activity[1]

ChemicalCAS5655-61-8MW196.29FormulaC12H20O2
CAS number
5655-61-8
Molecular weight
196.29
Formula
C12H20O2
Solubility
DMSO : 100 mg/mL
InChIKey
KGEKLUUHTZCSIP-HOSYDEDBSA-N
Catalogue number
GC26688
Brand
GLPBIO
Computed properties PubChem CID 93009 · XLogP 3.3 · TPSA 26.3 Ų · H-bond donors 0
XLogP
3.3
TPSA
26.3 Ų
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
14

SMILES CC(=O)O[C@@H]1C[C@@H]2CC[C@]1(C2(C)C)C

Computed descriptors from PubChem (CID 93009), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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