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Chemical structure of (+)-Bornyl acetate

GC26705

(+)-Bornyl acetate

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

(+)-Bornyl acetate is found in pichtae essential oil (Siberian fir needle oil)

ChemicalCAS20347-65-3MW196.29FormulaC12H20O2
CAS number
20347-65-3
Molecular weight
196.29
Formula
C12H20O2
Solubility
DMSO ： 100 mg/mL (509·45 mM; Need ultrasonic)
InChIKey
KGEKLUUHTZCSIP-SCVCMEIPSA-N
Catalogue number
GC26705
Brand
GLPBIO
Computed properties PubChem CID 6950274 · 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 6950274), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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