3-chloro-1,1,1,3-tetrafluoropropane

C3H3ClF4 — CID 2782294

IUPAC3-chloro-1,1,1,3-tetrafluoropropane
SMILESFC(Cl)CC(F)(F)F
InChIInChI=1S/C3H3ClF4/c4-2(5)1-3(6,7)8/h2H,1H2
InChIKeyZGOMEYREADWKLC-UHFFFAOYSA-N
MW150.50 g/mol
LogP2.47
Rot. Bonds1

About 3-chloro-1,1,1,3-tetrafluoropropane

3-chloro-1,1,1,3-tetrafluoropropane (PubChem CID 2782294) has the molecular formula C3H3ClF4 and a molecular weight of 150.50 g/mol. Its IUPAC name is 3-chloro-1,1,1,3-tetrafluoropropane.

Molecular Properties

Compound Name3-chloro-1,1,1,3-tetrafluoropropane
PubChem CID2782294
Molecular FormulaC3H3ClF4
Molecular Weight150.50 g/mol
Exact Mass149.99
IUPAC Name3-chloro-1,1,1,3-tetrafluoropropane
SMILESFC(Cl)CC(F)(F)F
InChIInChI=1S/C3H3ClF4/c4-2(5)1-3(6,7)8/h2H,1H2
InChIKeyZGOMEYREADWKLC-UHFFFAOYSA-N
XLogP2.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.50
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Hcfc 124
CID 17822
3,3-Dichloro-1,1,1,2,2-pentafluoropropane
CID 61112
1,3-Dichloro-1,1,2,2,3-pentafluoropropane
CID 62353
2-Chloro-1,1,1,3,3,3-hexafluoropropane
CID 9894
3-Chloro-1,1,1-trifluoropropane
CID 10000
3-Chloro-1,1,2,2-tetrafluoropropane
CID 120319
1-Chloro-1,1,2,2,3,3-hexafluoropropane
CID 67910
1,2-Dichloro-1,1,3,3,3-pentafluoropropane
CID 61115
1-Chloro-1,1,3,3,3-pentafluoropropane
CID 68031
3-Chloro-1,1,1,2,2-Pentafluoropropane
CID 67905
1-Chloro-1,2,2,3,3-pentafluoropropane
CID 102464
2,3-Dichloro-1,1,1,2,3-pentafluoropropane
CID 61111

Frequently Asked Questions

What is the IUPAC name of 3-chloro-1,1,1,3-tetrafluoropropane?
The IUPAC name of 3-chloro-1,1,1,3-tetrafluoropropane (CID 2782294) is 3-chloro-1,1,1,3-tetrafluoropropane.
What is the SMILES notation for 3-chloro-1,1,1,3-tetrafluoropropane?
The canonical SMILES for 3-chloro-1,1,1,3-tetrafluoropropane is FC(Cl)CC(F)(F)F.
What is the InChIKey of 3-chloro-1,1,1,3-tetrafluoropropane?
The InChIKey is ZGOMEYREADWKLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3ClF4/c4-2(5)1-3(6,7)8/h2H,1H2.
What are the key properties of 3-chloro-1,1,1,3-tetrafluoropropane?
3-chloro-1,1,1,3-tetrafluoropropane has a molecular weight of 150.50 g/mol, XLogP of 2.47, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-1,1,1,3-tetrafluoropropane is sourced from PubChem (CID 2782294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).