1,1,3,3-tetrafluoro-1,3-diiodopropane

C3H2F4I2 — CID 11314626

IUPAC1,1,3,3-tetrafluoro-1,3-diiodopropane
SMILESFC(F)(I)CC(F)(F)I
InChIInChI=1S/C3H2F4I2/c4-2(5,8)1-3(6,7)9/h1H2
InChIKeyKRSLCBAHLLTOTJ-UHFFFAOYSA-N
MW367.85 g/mol
LogP3.43
Rot. Bonds2

About 1,1,3,3-tetrafluoro-1,3-diiodopropane

1,1,3,3-tetrafluoro-1,3-diiodopropane (PubChem CID 11314626) has the molecular formula C3H2F4I2 and a molecular weight of 367.85 g/mol. Its IUPAC name is 1,1,3,3-tetrafluoro-1,3-diiodopropane.

Molecular Properties

Compound Name1,1,3,3-tetrafluoro-1,3-diiodopropane
PubChem CID11314626
Molecular FormulaC3H2F4I2
Molecular Weight367.85 g/mol
Exact Mass367.82
IUPAC Name1,1,3,3-tetrafluoro-1,3-diiodopropane
SMILESFC(F)(I)CC(F)(F)I
InChIInChI=1S/C3H2F4I2/c4-2(5,8)1-3(6,7)9/h1H2
InChIKeyKRSLCBAHLLTOTJ-UHFFFAOYSA-N
XLogP3.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.85
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,1,3,3-tetrafluoro-1,3-diiodopropane?
The IUPAC name of 1,1,3,3-tetrafluoro-1,3-diiodopropane (CID 11314626) is 1,1,3,3-tetrafluoro-1,3-diiodopropane.
What is the SMILES notation for 1,1,3,3-tetrafluoro-1,3-diiodopropane?
The canonical SMILES for 1,1,3,3-tetrafluoro-1,3-diiodopropane is FC(F)(I)CC(F)(F)I.
What is the InChIKey of 1,1,3,3-tetrafluoro-1,3-diiodopropane?
The InChIKey is KRSLCBAHLLTOTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H2F4I2/c4-2(5,8)1-3(6,7)9/h1H2.
What are the key properties of 1,1,3,3-tetrafluoro-1,3-diiodopropane?
1,1,3,3-tetrafluoro-1,3-diiodopropane has a molecular weight of 367.85 g/mol, XLogP of 3.43, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,3,3-tetrafluoro-1,3-diiodopropane is sourced from PubChem (CID 11314626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).