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Chemical structure of Hydroxychavicol

GC30193

Hydroxychavicol

Also listed as 4-Allylcatechol (4-Allylpyrocatechol)

4-Allylcatechol (4-Allylpyrocatechol) (4-Allylpyrocatechol, Hydroxychavicol) is an intermediate to synthetic safrole

ChemicalCAS1126-61-0MW150.17FormulaC9H10O2
CAS number
1126-61-0
Molecular weight
150.17
Formula
C9H10O2
Solubility
DMSO ： ≥ 100 mg/mL (665·91 mM)
InChIKey
FHEHIXJLCWUPCZ-UHFFFAOYSA-N
Catalogue number
GC30193
Brand
GLPBIO
Computed properties PubChem CID 70775 · XLogP 0.8 · TPSA 40.5 Ų · H-bond donors 2
XLogP
0.8
TPSA
40.5 Ų
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
11

SMILES C=CCC1=CC(=C(C=C1)O)O

Computed descriptors from PubChem (CID 70775), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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