1-fluoropropa-1,2-diene

C3H3F — CID 637949

IUPAC1-fluoropropa-1,2-diene
SMILESC=C=CF
InChIInChI=1S/C3H3F/c1-2-3-4/h3H,1H2
InChIKeyVTHXGEUPADCJRY-UHFFFAOYSA-N
MW58.05 g/mol
LogP1.25
Rot. Bonds

About 1-fluoropropa-1,2-diene

1-fluoropropa-1,2-diene (PubChem CID 637949) has the molecular formula C3H3F and a molecular weight of 58.05 g/mol. Its IUPAC name is 1-fluoropropa-1,2-diene.

Molecular Properties

Compound Name1-fluoropropa-1,2-diene
PubChem CID637949
Molecular FormulaC3H3F
Molecular Weight58.05 g/mol
Exact Mass58.02
IUPAC Name1-fluoropropa-1,2-diene
SMILESC=C=CF
InChIInChI=1S/C3H3F/c1-2-3-4/h3H,1H2
InChIKeyVTHXGEUPADCJRY-UHFFFAOYSA-N
XLogP1.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50058.05
LogP ≤ 51.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,3-Difluoroallene
CID 12590904
1-Fluorobuta-1,2,3-triene
CID 22392513
1-Fluorohexapentaene
CID 71426861
1,3-Difluoropropa-1,2-diene
CID 101376862
1-Fluoropenta-1,2,3,4-tetraene
CID 160751581
1-Fluoropropa-1,2-diene
CID 177486044
1-Fluoropropa-1,2-diene;yttrium
CID 140873420
Lithium 1-deuterio-3-fluoropropa-1,2-diene
CID 71661941
1-Deuterio-3-fluoropropa-1,2-diene
CID 71661942
CID 101376857
CID 101376857

Frequently Asked Questions

What is the IUPAC name of 1-fluoropropa-1,2-diene?
The IUPAC name of 1-fluoropropa-1,2-diene (CID 637949) is 1-fluoropropa-1,2-diene.
What is the SMILES notation for 1-fluoropropa-1,2-diene?
The canonical SMILES for 1-fluoropropa-1,2-diene is C=C=CF.
What is the InChIKey of 1-fluoropropa-1,2-diene?
The InChIKey is VTHXGEUPADCJRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3F/c1-2-3-4/h3H,1H2.
What are the key properties of 1-fluoropropa-1,2-diene?
1-fluoropropa-1,2-diene has a molecular weight of 58.05 g/mol, XLogP of 1.25, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoropropa-1,2-diene is sourced from PubChem (CID 637949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).