1-fluoropenta-2,3-diene

C5H7F — CID 56631230

IUPAC1-fluoropenta-2,3-diene
SMILESCC=C=CCF
InChIInChI=1S/C5H7F/c1-2-3-4-5-6/h2,4H,5H2,1H3
InChIKeyXCZGZDDCCPDBDI-UHFFFAOYSA-N
MW86.11 g/mol
LogP1.69
Rot. Bonds1

About 1-fluoropenta-2,3-diene

1-fluoropenta-2,3-diene (PubChem CID 56631230) has the molecular formula C5H7F and a molecular weight of 86.11 g/mol. Its IUPAC name is 1-fluoropenta-2,3-diene.

Molecular Properties

Compound Name1-fluoropenta-2,3-diene
PubChem CID56631230
Molecular FormulaC5H7F
Molecular Weight86.11 g/mol
Exact Mass86.05
IUPAC Name1-fluoropenta-2,3-diene
SMILESCC=C=CCF
InChIInChI=1S/C5H7F/c1-2-3-4-5-6/h2,4H,5H2,1H3
InChIKeyXCZGZDDCCPDBDI-UHFFFAOYSA-N
XLogP1.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50086.11
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,2-Butadiene
CID 11535
(Z)-2-Fluoro-2-butene
CID 12756876
(E)-2-Fluoro-2-butene
CID 12756877
2-Fluorobut-2-ene
CID 20806750
1,1,1-Trifluoropenta-2,3-diene
CID 56991262
Penta-1,2,3-triene
CID 13593933
Hexatetraene
CID 11815814
1,1-Difluoropenta-2,3-diene
CID 15710922
1,1-Difluorobuta-1,2-diene
CID 20197104
4-Fluorobuta-1,2-diene
CID 22159642
1-Fluoropenta-1,2-diene
CID 56629817
5-Fluoropenta-1,2,3-triene
CID 56990538

Frequently Asked Questions

What is the IUPAC name of 1-fluoropenta-2,3-diene?
The IUPAC name of 1-fluoropenta-2,3-diene (CID 56631230) is 1-fluoropenta-2,3-diene.
What is the SMILES notation for 1-fluoropenta-2,3-diene?
The canonical SMILES for 1-fluoropenta-2,3-diene is CC=C=CCF.
What is the InChIKey of 1-fluoropenta-2,3-diene?
The InChIKey is XCZGZDDCCPDBDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7F/c1-2-3-4-5-6/h2,4H,5H2,1H3.
What are the key properties of 1-fluoropenta-2,3-diene?
1-fluoropenta-2,3-diene has a molecular weight of 86.11 g/mol, XLogP of 1.69, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoropenta-2,3-diene is sourced from PubChem (CID 56631230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).