2,6-dichloro-4-methoxyphenol

C7H6Cl2O2 — CID 11735682

IUPAC2,6-dichloro-4-methoxyphenol
SMILESCOc1cc(Cl)c(O)c(Cl)c1
InChIInChI=1S/C7H6Cl2O2/c1-11-4-2-5(8)7(10)6(9)3-4/h2-3,10H,1H3
InChIKeyVMZNOEKGSGWAQS-UHFFFAOYSA-N
MW193.03 g/mol
LogP2.71
Rot. Bonds1

About 2,6-dichloro-4-methoxyphenol

2,6-dichloro-4-methoxyphenol (PubChem CID 11735682) has the molecular formula C7H6Cl2O2 and a molecular weight of 193.03 g/mol. Its IUPAC name is 2,6-dichloro-4-methoxyphenol.

Molecular Properties

Compound Name2,6-dichloro-4-methoxyphenol
PubChem CID11735682
Molecular FormulaC7H6Cl2O2
Molecular Weight193.03 g/mol
Exact Mass191.97
IUPAC Name2,6-dichloro-4-methoxyphenol
SMILESCOc1cc(Cl)c(O)c(Cl)c1
InChIInChI=1S/C7H6Cl2O2/c1-11-4-2-5(8)7(10)6(9)3-4/h2-3,10H,1H3
InChIKeyVMZNOEKGSGWAQS-UHFFFAOYSA-N
XLogP2.71
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.03
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-4-methoxyphenol?
The IUPAC name of 2,6-dichloro-4-methoxyphenol (CID 11735682) is 2,6-dichloro-4-methoxyphenol.
What is the SMILES notation for 2,6-dichloro-4-methoxyphenol?
The canonical SMILES for 2,6-dichloro-4-methoxyphenol is COc1cc(Cl)c(O)c(Cl)c1.
What is the InChIKey of 2,6-dichloro-4-methoxyphenol?
The InChIKey is VMZNOEKGSGWAQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6Cl2O2/c1-11-4-2-5(8)7(10)6(9)3-4/h2-3,10H,1H3.
What are the key properties of 2,6-dichloro-4-methoxyphenol?
2,6-dichloro-4-methoxyphenol has a molecular weight of 193.03 g/mol, XLogP of 2.71, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-4-methoxyphenol is sourced from PubChem (CID 11735682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).