2-chloro-6-fluorophenol

C6H4ClFO — CID 2773710

IUPAC2-chloro-6-fluorophenol
SMILESOc1c(F)cccc1Cl
InChIInChI=1S/C6H4ClFO/c7-4-2-1-3-5(8)6(4)9/h1-3,9H
InChIKeyQIAQIYQASAWZPP-UHFFFAOYSA-N
MW146.55 g/mol
LogP2.18
Rot. Bonds

About 2-chloro-6-fluorophenol

2-chloro-6-fluorophenol (PubChem CID 2773710) has the molecular formula C6H4ClFO and a molecular weight of 146.55 g/mol. Its IUPAC name is 2-chloro-6-fluorophenol.

Molecular Properties

Compound Name2-chloro-6-fluorophenol
PubChem CID2773710
Molecular FormulaC6H4ClFO
Molecular Weight146.55 g/mol
Exact Mass145.99
IUPAC Name2-chloro-6-fluorophenol
SMILESOc1c(F)cccc1Cl
InChIInChI=1S/C6H4ClFO/c7-4-2-1-3-5(8)6(4)9/h1-3,9H
InChIKeyQIAQIYQASAWZPP-UHFFFAOYSA-N
XLogP2.18
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.55
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-fluorophenol?
The IUPAC name of 2-chloro-6-fluorophenol (CID 2773710) is 2-chloro-6-fluorophenol.
What is the SMILES notation for 2-chloro-6-fluorophenol?
The canonical SMILES for 2-chloro-6-fluorophenol is Oc1c(F)cccc1Cl.
What is the InChIKey of 2-chloro-6-fluorophenol?
The InChIKey is QIAQIYQASAWZPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4ClFO/c7-4-2-1-3-5(8)6(4)9/h1-3,9H.
What are the key properties of 2-chloro-6-fluorophenol?
2-chloro-6-fluorophenol has a molecular weight of 146.55 g/mol, XLogP of 2.18, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-fluorophenol is sourced from PubChem (CID 2773710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).