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Chemical structure of 3-(Sulfooxy)benzenepropanoic acid

GC52324

3-(Sulfooxy)benzenepropanoic acid

Also listed as 3-(3-Hydroxyphenyl)propionic Acid sulfate

A metabolite of certain phenols and glycosides

ChemicalCAS86321-32-6MW246.2FormulaC9H10O6S
CAS number
86321-32-6
Molecular weight
246.2
Formula
C9H10O6S
Solubility
Methanol： soluble
InChIKey
IQWLPDPKVFZEOK-UHFFFAOYSA-N
Catalogue number
GC52324
Brand
GLPBIO
Computed properties PubChem CID 187488 · XLogP 0.7 · TPSA 109 Ų · H-bond donors 2
XLogP
0.7
TPSA
109 Ų
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
16

SMILES C1=CC(=CC(=C1)OS(=O)(=O)O)CCC(=O)O

Computed descriptors from PubChem (CID 187488), 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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Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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