phenol;trihydrochloride;hydrofluoride

C6H10Cl3FO — CID 174750798

IUPACphenol;trihydrochloride;hydrofluoride
SMILESCl.Cl.Cl.F.Oc1ccccc1
InChIInChI=1S/C6H6O.3ClH.FH/c7-6-4-2-1-3-5-6;;;;/h1-5,7H;4*1H
InChIKeyLWXLHVNYTMMMPC-UHFFFAOYSA-N
MW223.50 g/mol
LogP2.81
Rot. Bonds

About phenol;trihydrochloride;hydrofluoride

phenol;trihydrochloride;hydrofluoride (PubChem CID 174750798) has the molecular formula C6H10Cl3FO and a molecular weight of 223.50 g/mol. Its IUPAC name is phenol;trihydrochloride;hydrofluoride.

Molecular Properties

Compound Namephenol;trihydrochloride;hydrofluoride
PubChem CID174750798
Molecular FormulaC6H10Cl3FO
Molecular Weight223.50 g/mol
Exact Mass221.98
IUPAC Namephenol;trihydrochloride;hydrofluoride
SMILESCl.Cl.Cl.F.Oc1ccccc1
InChIInChI=1S/C6H6O.3ClH.FH/c7-6-4-2-1-3-5-6;;;;/h1-5,7H;4*1H
InChIKeyLWXLHVNYTMMMPC-UHFFFAOYSA-N
XLogP2.81
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.50
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of phenol;trihydrochloride;hydrofluoride?
The IUPAC name of phenol;trihydrochloride;hydrofluoride (CID 174750798) is phenol;trihydrochloride;hydrofluoride.
What is the SMILES notation for phenol;trihydrochloride;hydrofluoride?
The canonical SMILES for phenol;trihydrochloride;hydrofluoride is Cl.Cl.Cl.F.Oc1ccccc1.
What is the InChIKey of phenol;trihydrochloride;hydrofluoride?
The InChIKey is LWXLHVNYTMMMPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6O.3ClH.FH/c7-6-4-2-1-3-5-6;;;;/h1-5,7H;4*1H.
What are the key properties of phenol;trihydrochloride;hydrofluoride?
phenol;trihydrochloride;hydrofluoride has a molecular weight of 223.50 g/mol, XLogP of 2.81, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for phenol;trihydrochloride;hydrofluoride is sourced from PubChem (CID 174750798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).