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Chemical structure of β-Caryophyllene-d2

GC71980

β-Caryophyllene-d2

Also known as (1R,4Z,9S)-8-(dideuteriomethylidene)-4,11,11-trimethylbicyclo[7.2.0]undec-4-ene

β-Caryophyllene-d2 is deuterium labeled β-Caryophyllene

ChemicalCAS2006272-96-2MW206.36FormulaC15H22D2
CAS number
2006272-96-2
Molecular weight
206.36
Formula
C15H22D2
Solubility
Ethanol ： ≥ 176·67 mg/mL (856·13 mM); DMSO ： 50 mg/mL (242·30 mM; ultrasonic and warming and heat to 60°C); H2O ： 0·67 mg/mL (3·25 mM; Need ultrasonic)
InChIKey
NPNUFJAVOOONJE-DUOVYBGSSA-N
Catalogue number
GC71980
Brand
GLPBIO
Computed properties PubChem CID 163322627 · XLogP 4.4 · TPSA 0 Ų · H-bond donors 0
XLogP
4.4
TPSA
0 Ų
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
0
Heavy atoms
15

SMILES [2H]C(=C1CC/C=C(\CC[C@@H]2[C@@H]1CC2(C)C)/C)[2H]

Computed descriptors from PubChem (CID 163322627), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Documents
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