1-fluoro-1-iodoprop-1-ene

C3H4FI — CID 175825519

IUPAC1-fluoro-1-iodoprop-1-ene
SMILESCC=C(F)I
InChIInChI=1S/C3H4FI/c1-2-3(4)5/h2H,1H3
InChIKeyDKEPSVLMHRNWRG-UHFFFAOYSA-N
MW185.97 g/mol
LogP2.25
Rot. Bonds

About 1-fluoro-1-iodoprop-1-ene

1-fluoro-1-iodoprop-1-ene (PubChem CID 175825519) has the molecular formula C3H4FI and a molecular weight of 185.97 g/mol. Its IUPAC name is 1-fluoro-1-iodoprop-1-ene.

Molecular Properties

Compound Name1-fluoro-1-iodoprop-1-ene
PubChem CID175825519
Molecular FormulaC3H4FI
Molecular Weight185.97 g/mol
Exact Mass185.93
IUPAC Name1-fluoro-1-iodoprop-1-ene
SMILESCC=C(F)I
InChIInChI=1S/C3H4FI/c1-2-3(4)5/h2H,1H3
InChIKeyDKEPSVLMHRNWRG-UHFFFAOYSA-N
XLogP2.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.97
LogP ≤ 52.25
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 1-fluoro-1-iodoprop-1-ene?
The IUPAC name of 1-fluoro-1-iodoprop-1-ene (CID 175825519) is 1-fluoro-1-iodoprop-1-ene.
What is the SMILES notation for 1-fluoro-1-iodoprop-1-ene?
The canonical SMILES for 1-fluoro-1-iodoprop-1-ene is CC=C(F)I.
What is the InChIKey of 1-fluoro-1-iodoprop-1-ene?
The InChIKey is DKEPSVLMHRNWRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4FI/c1-2-3(4)5/h2H,1H3.
What are the key properties of 1-fluoro-1-iodoprop-1-ene?
1-fluoro-1-iodoprop-1-ene has a molecular weight of 185.97 g/mol, XLogP of 2.25, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-1-iodoprop-1-ene is sourced from PubChem (CID 175825519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).