fluoroethane;trihydrochloride

C2H8Cl3F — CID 172790972

IUPACfluoroethane;trihydrochloride
SMILESCCF.Cl.Cl.Cl
InChIInChI=1S/C2H5F.3ClH/c1-2-3;;;/h2H2,1H3;3*1H
InChIKeyPOHPAPMWDQLZAB-UHFFFAOYSA-N
MW157.44 g/mol
LogP2.24
Rot. Bonds

About fluoroethane;trihydrochloride

fluoroethane;trihydrochloride (PubChem CID 172790972) has the molecular formula C2H8Cl3F and a molecular weight of 157.44 g/mol. Its IUPAC name is fluoroethane;trihydrochloride.

Molecular Properties

Compound Namefluoroethane;trihydrochloride
PubChem CID172790972
Molecular FormulaC2H8Cl3F
Molecular Weight157.44 g/mol
Exact Mass155.97
IUPAC Namefluoroethane;trihydrochloride
SMILESCCF.Cl.Cl.Cl
InChIInChI=1S/C2H5F.3ClH/c1-2-3;;;/h2H2,1H3;3*1H
InChIKeyPOHPAPMWDQLZAB-UHFFFAOYSA-N
XLogP2.24
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.44
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of fluoroethane;trihydrochloride?
The IUPAC name of fluoroethane;trihydrochloride (CID 172790972) is fluoroethane;trihydrochloride.
What is the SMILES notation for fluoroethane;trihydrochloride?
The canonical SMILES for fluoroethane;trihydrochloride is CCF.Cl.Cl.Cl.
What is the InChIKey of fluoroethane;trihydrochloride?
The InChIKey is POHPAPMWDQLZAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5F.3ClH/c1-2-3;;;/h2H2,1H3;3*1H.
What are the key properties of fluoroethane;trihydrochloride?
fluoroethane;trihydrochloride has a molecular weight of 157.44 g/mol, XLogP of 2.24, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for fluoroethane;trihydrochloride is sourced from PubChem (CID 172790972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).