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Chemical structure of 3-Hydroxyacetophenone

GC61707

3-Hydroxyacetophenone

Also known as 1-(3-hydroxyphenyl)ethanone

3-Hydroxyacetophenone (m-Hydroxyacetophenone) is the hydroxy-substituted alkyl phenyl ketone that can be used in synthesis of enantiopure (-)-rivastigmine

ChemicalCAS121-71-1MW136.15FormulaC8H8O2
CAS number
121-71-1
Molecular weight
136.15
Formula
C8H8O2
Solubility
DMSO : 100 mg/mL (734·48 mM; Need ultrasonic)
InChIKey
LUJMEECXHPYQOF-UHFFFAOYSA-N
Catalogue number
GC61707
Brand
GLPBIO
Computed properties PubChem CID 8487 · XLogP 1.4 · TPSA 37.3 Ų · H-bond donors 1
XLogP
1.4
TPSA
37.3 Ų
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
10

SMILES CC(=O)C1=CC(=CC=C1)O

Computed descriptors from PubChem (CID 8487), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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