trichloro(fluoro)methane;hydrofluoride

CHCl3F2 — CID 174977580

IUPACtrichloro(fluoro)methane;hydrofluoride
SMILESF.FC(Cl)(Cl)Cl
InChIInChI=1S/CCl3F.FH/c2-1(3,4)5;/h;1H
InChIKeyDKGZZVLUVKYMOK-UHFFFAOYSA-N
MW157.37 g/mol
LogP2.44
Rot. Bonds

About trichloro(fluoro)methane;hydrofluoride

trichloro(fluoro)methane;hydrofluoride (PubChem CID 174977580) has the molecular formula CHCl3F2 and a molecular weight of 157.37 g/mol. Its IUPAC name is trichloro(fluoro)methane;hydrofluoride.

Molecular Properties

Compound Nametrichloro(fluoro)methane;hydrofluoride
PubChem CID174977580
Molecular FormulaCHCl3F2
Molecular Weight157.37 g/mol
Exact Mass155.91
IUPAC Nametrichloro(fluoro)methane;hydrofluoride
SMILESF.FC(Cl)(Cl)Cl
InChIInChI=1S/CCl3F.FH/c2-1(3,4)5;/h;1H
InChIKeyDKGZZVLUVKYMOK-UHFFFAOYSA-N
XLogP2.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.37
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trichloro(fluoro)methane;hydrofluoride?
The IUPAC name of trichloro(fluoro)methane;hydrofluoride (CID 174977580) is trichloro(fluoro)methane;hydrofluoride.
What is the SMILES notation for trichloro(fluoro)methane;hydrofluoride?
The canonical SMILES for trichloro(fluoro)methane;hydrofluoride is F.FC(Cl)(Cl)Cl.
What is the InChIKey of trichloro(fluoro)methane;hydrofluoride?
The InChIKey is DKGZZVLUVKYMOK-UHFFFAOYSA-N. The full InChI is InChI=1S/CCl3F.FH/c2-1(3,4)5;/h;1H.
What are the key properties of trichloro(fluoro)methane;hydrofluoride?
trichloro(fluoro)methane;hydrofluoride has a molecular weight of 157.37 g/mol, XLogP of 2.44, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trichloro(fluoro)methane;hydrofluoride is sourced from PubChem (CID 174977580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).