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Chemical structure of 3,6-Dichlorocatechol

GC70695

3,6-Dichlorocatechol

Also known as 3,6-dichlorobenzene-1,2-diol

3,6-Dichlorocatechol is a substrate of the broad-spectrum chlorocatechol 1,2-dioxygenase of pseudomonas chlororaphis RW71

ChemicalCAS3938-16-7MW179FormulaC6H4Cl2O2
CAS number
3938-16-7
Molecular weight
179
Formula
C6H4Cl2O2
InChIKey
OLCABUKQCUOXNU-UHFFFAOYSA-N
Catalogue number
GC70695
Brand
GLPBIO
Computed properties PubChem CID 32819 · XLogP 2.8 · TPSA 40.5 Ų · H-bond donors 2
XLogP
2.8
TPSA
40.5 Ų
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
10

SMILES C1=CC(=C(C(=C1Cl)O)O)Cl

Computed descriptors from PubChem (CID 32819), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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