(E)-1,2,3,3,3-pentafluoro-1-iodoprop-1-ene

C3F5I — CID 11345907

IUPAC(E)-1,2,3,3,3-pentafluoro-1-iodoprop-1-ene
SMILESF/C(I)=C(\F)C(F)(F)F
InChIInChI=1S/C3F5I/c4-1(2(5)9)3(6,7)8/b2-1+
InChIKeyRMHNIOZYXWTWOP-OWOJBTEDSA-N
MW257.93 g/mol
LogP3.09
Rot. Bonds

About (E)-1,2,3,3,3-pentafluoro-1-iodoprop-1-ene

(E)-1,2,3,3,3-pentafluoro-1-iodoprop-1-ene (PubChem CID 11345907) has the molecular formula C3F5I and a molecular weight of 257.93 g/mol. Its IUPAC name is (E)-1,2,3,3,3-pentafluoro-1-iodoprop-1-ene.

Molecular Properties

Compound Name(E)-1,2,3,3,3-pentafluoro-1-iodoprop-1-ene
PubChem CID11345907
Molecular FormulaC3F5I
Molecular Weight257.93 g/mol
Exact Mass257.90
IUPAC Name(E)-1,2,3,3,3-pentafluoro-1-iodoprop-1-ene
SMILESF/C(I)=C(\F)C(F)(F)F
InChIInChI=1S/C3F5I/c4-1(2(5)9)3(6,7)8/b2-1+
InChIKeyRMHNIOZYXWTWOP-OWOJBTEDSA-N
XLogP3.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.93
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (E)-1,2,3,3,3-pentafluoro-1-iodoprop-1-ene?
The IUPAC name of (E)-1,2,3,3,3-pentafluoro-1-iodoprop-1-ene (CID 11345907) is (E)-1,2,3,3,3-pentafluoro-1-iodoprop-1-ene.
What is the SMILES notation for (E)-1,2,3,3,3-pentafluoro-1-iodoprop-1-ene?
The canonical SMILES for (E)-1,2,3,3,3-pentafluoro-1-iodoprop-1-ene is F/C(I)=C(\F)C(F)(F)F.
What is the InChIKey of (E)-1,2,3,3,3-pentafluoro-1-iodoprop-1-ene?
The InChIKey is RMHNIOZYXWTWOP-OWOJBTEDSA-N. The full InChI is InChI=1S/C3F5I/c4-1(2(5)9)3(6,7)8/b2-1+.
What are the key properties of (E)-1,2,3,3,3-pentafluoro-1-iodoprop-1-ene?
(E)-1,2,3,3,3-pentafluoro-1-iodoprop-1-ene has a molecular weight of 257.93 g/mol, XLogP of 3.09, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1,2,3,3,3-pentafluoro-1-iodoprop-1-ene is sourced from PubChem (CID 11345907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).