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4,6-Dichloroguaiacol

CAT: 0013-GTR19190324Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19190324Size:25 mg
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Description
This small molecule induces biochemical and morphological changes in human peripheral blood lymphocytes in vitro. It is used in toxicology and immunology research to study cellular responses to environmental pollutants and halogenated aromatic compounds.
CAS Number
16766-31-7
Field of Research
Cell Biology, Molecular Biology
Smiles
COc1cc (Cl) cc (Cl) c1O
Molecular Formula
C7H6Cl2O2
Molecular Weight
193.02
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2,4-Dichloro-6-methoxyphenol
CAS Number16766-31-7
PubChem CID28051
IUPAC Name2,4-dichloro-6-methoxyphenol
Molecular FormulaC7H6Cl2O2
Molecular Weight193.02
XLogP1.8
Topological Polar Surface Area29.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count11
Formal Charge0
Complexity132
SMILES
COC1=C(C(=CC(=C1)Cl)Cl)O
InChI
InChI=1S/C7H6Cl2O2/c1-11-6-3-4(8)2-5(9)7(6)10/h2-3,10H,1H3
InChIKey
RHQIMIYFOSAUQT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,4-Dichloro-6-methoxyphenol
CAS: 16766-31-7
CID: 28051
Formula: C7H6Cl2O2
MW: 193.02
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight193.02
XLogP31.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass191.9744848
Monoisotopic Mass191.9744848
Topological Polar Surface Area29.5 Ų
Heavy Atom Count11
Formal Charge0
Complexity132
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes