3,3-difluorohex-1-ene

C6H10F2 — CID 54512479

IUPAC3,3-difluorohex-1-ene
SMILESC=CC(F)(F)CCC
InChIInChI=1S/C6H10F2/c1-3-5-6(7,8)4-2/h4H,2-3,5H2,1H3
InChIKeyAJIILBAOLXOBRX-UHFFFAOYSA-N
MW120.14 g/mol
LogP2.61
Rot. Bonds3

About 3,3-difluorohex-1-ene

3,3-difluorohex-1-ene (PubChem CID 54512479) has the molecular formula C6H10F2 and a molecular weight of 120.14 g/mol. Its IUPAC name is 3,3-difluorohex-1-ene.

Molecular Properties

Compound Name3,3-difluorohex-1-ene
PubChem CID54512479
Molecular FormulaC6H10F2
Molecular Weight120.14 g/mol
Exact Mass120.08
IUPAC Name3,3-difluorohex-1-ene
SMILESC=CC(F)(F)CCC
InChIInChI=1S/C6H10F2/c1-3-5-6(7,8)4-2/h4H,2-3,5H2,1H3
InChIKeyAJIILBAOLXOBRX-UHFFFAOYSA-N
XLogP2.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.14
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

3,3,4,4,5,5,6,6-Octafluoro-1-hexene
CID 15828066
3,3-Difluorobut-1-ene
CID 14123435
1,1-Difluoroocta-1,2-diene
CID 23235855
1,1,2-Trifluorohex-1-ene
CID 10844440
1,1-Difluoropent-1-ene
CID 13087753
3-Fluorohex-1-ene
CID 23437622
Fluorohexene
CID 57359528
cis-1-Fluoro-1-hexene
CID 87950676
6,6-Difluorohex-1-ene
CID 10796733
1,1-Difluoro-1,5-hexadiene
CID 13495442
5,5-Difluorohex-1-ene
CID 15828064
2,2-Difluoro 4-pentene
CID 20149483

Frequently Asked Questions

What is the IUPAC name of 3,3-difluorohex-1-ene?
The IUPAC name of 3,3-difluorohex-1-ene (CID 54512479) is 3,3-difluorohex-1-ene.
What is the SMILES notation for 3,3-difluorohex-1-ene?
The canonical SMILES for 3,3-difluorohex-1-ene is C=CC(F)(F)CCC.
What is the InChIKey of 3,3-difluorohex-1-ene?
The InChIKey is AJIILBAOLXOBRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F2/c1-3-5-6(7,8)4-2/h4H,2-3,5H2,1H3.
What are the key properties of 3,3-difluorohex-1-ene?
3,3-difluorohex-1-ene has a molecular weight of 120.14 g/mol, XLogP of 2.61, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluorohex-1-ene is sourced from PubChem (CID 54512479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).