2,4-dichloro-6-(furan-2-yl)phenol

C10H6Cl2O2 — CID 168524545

IUPAC2,4-dichloro-6-(furan-2-yl)phenol
SMILESOc1c(Cl)cc(Cl)cc1-c1ccco1
InChIInChI=1S/C10H6Cl2O2/c11-6-4-7(9-2-1-3-14-9)10(13)8(12)5-6/h1-5,13H
InChIKeyXGWLRMGEMDQKMT-UHFFFAOYSA-N
MW229.06 g/mol
LogP3.96
Rot. Bonds1

About 2,4-dichloro-6-(furan-2-yl)phenol

2,4-dichloro-6-(furan-2-yl)phenol (PubChem CID 168524545) has the molecular formula C10H6Cl2O2 and a molecular weight of 229.06 g/mol. Its IUPAC name is 2,4-dichloro-6-(furan-2-yl)phenol.

Molecular Properties

Compound Name2,4-dichloro-6-(furan-2-yl)phenol
PubChem CID168524545
Molecular FormulaC10H6Cl2O2
Molecular Weight229.06 g/mol
Exact Mass227.97
IUPAC Name2,4-dichloro-6-(furan-2-yl)phenol
SMILESOc1c(Cl)cc(Cl)cc1-c1ccco1
InChIInChI=1S/C10H6Cl2O2/c11-6-4-7(9-2-1-3-14-9)10(13)8(12)5-6/h1-5,13H
InChIKeyXGWLRMGEMDQKMT-UHFFFAOYSA-N
XLogP3.96
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.06
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-6-(furan-2-yl)phenol?
The IUPAC name of 2,4-dichloro-6-(furan-2-yl)phenol (CID 168524545) is 2,4-dichloro-6-(furan-2-yl)phenol.
What is the SMILES notation for 2,4-dichloro-6-(furan-2-yl)phenol?
The canonical SMILES for 2,4-dichloro-6-(furan-2-yl)phenol is Oc1c(Cl)cc(Cl)cc1-c1ccco1.
What is the InChIKey of 2,4-dichloro-6-(furan-2-yl)phenol?
The InChIKey is XGWLRMGEMDQKMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Cl2O2/c11-6-4-7(9-2-1-3-14-9)10(13)8(12)5-6/h1-5,13H.
What are the key properties of 2,4-dichloro-6-(furan-2-yl)phenol?
2,4-dichloro-6-(furan-2-yl)phenol has a molecular weight of 229.06 g/mol, XLogP of 3.96, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-6-(furan-2-yl)phenol is sourced from PubChem (CID 168524545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).