1-chloro-1,3,3,3-tetrafluoroprop-1-ene

C3HClF4 — CID 2782297

IUPAC1-chloro-1,3,3,3-tetrafluoroprop-1-ene
SMILESFC(Cl)=CC(F)(F)F
InChIInChI=1S/C3HClF4/c4-2(5)1-3(6,7)8/h1H
InChIKeyPNWJILFKWURCIR-UHFFFAOYSA-N
MW148.49 g/mol
LogP2.60
Rot. Bonds

About 1-chloro-1,3,3,3-tetrafluoroprop-1-ene

1-chloro-1,3,3,3-tetrafluoroprop-1-ene (PubChem CID 2782297) has the molecular formula C3HClF4 and a molecular weight of 148.49 g/mol. Its IUPAC name is 1-chloro-1,3,3,3-tetrafluoroprop-1-ene.

Molecular Properties

Compound Name1-chloro-1,3,3,3-tetrafluoroprop-1-ene
PubChem CID2782297
Molecular FormulaC3HClF4
Molecular Weight148.49 g/mol
Exact Mass147.97
IUPAC Name1-chloro-1,3,3,3-tetrafluoroprop-1-ene
SMILESFC(Cl)=CC(F)(F)F
InChIInChI=1S/C3HClF4/c4-2(5)1-3(6,7)8/h1H
InChIKeyPNWJILFKWURCIR-UHFFFAOYSA-N
XLogP2.60
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.49
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-chloro-1,3,3,3-tetrafluoroprop-1-ene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-chloro-1,3,3,3-tetrafluoroprop-1-ene?
The IUPAC name of 1-chloro-1,3,3,3-tetrafluoroprop-1-ene (CID 2782297) is 1-chloro-1,3,3,3-tetrafluoroprop-1-ene.
What is the SMILES notation for 1-chloro-1,3,3,3-tetrafluoroprop-1-ene?
The canonical SMILES for 1-chloro-1,3,3,3-tetrafluoroprop-1-ene is FC(Cl)=CC(F)(F)F.
What is the InChIKey of 1-chloro-1,3,3,3-tetrafluoroprop-1-ene?
The InChIKey is PNWJILFKWURCIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C3HClF4/c4-2(5)1-3(6,7)8/h1H.
What are the key properties of 1-chloro-1,3,3,3-tetrafluoroprop-1-ene?
1-chloro-1,3,3,3-tetrafluoroprop-1-ene has a molecular weight of 148.49 g/mol, XLogP of 2.60, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-1,3,3,3-tetrafluoroprop-1-ene is sourced from PubChem (CID 2782297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).