5,5-difluorohex-1-ene

C6H10F2 — CID 15828064

IUPAC5,5-difluorohex-1-ene
SMILESC=CCCC(C)(F)F
InChIInChI=1S/C6H10F2/c1-3-4-5-6(2,7)8/h3H,1,4-5H2,2H3
InChIKeyPQBCFPCHDLMXPJ-UHFFFAOYSA-N
MW120.14 g/mol
LogP2.61
Rot. Bonds3

About 5,5-difluorohex-1-ene

5,5-difluorohex-1-ene (PubChem CID 15828064) has the molecular formula C6H10F2 and a molecular weight of 120.14 g/mol. Its IUPAC name is 5,5-difluorohex-1-ene.

Molecular Properties

Compound Name5,5-difluorohex-1-ene
PubChem CID15828064
Molecular FormulaC6H10F2
Molecular Weight120.14 g/mol
Exact Mass120.08
IUPAC Name5,5-difluorohex-1-ene
SMILESC=CCCC(C)(F)F
InChIInChI=1S/C6H10F2/c1-3-4-5-6(2,7)8/h3H,1,4-5H2,2H3
InChIKeyPQBCFPCHDLMXPJ-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

1-Hexene, 6-fluoro-
CID 9761
4,4,5,6,6,6-Hexafluoro-1-hexene
CID 15134947
1,1,1-Trifluoro-2-heptene
CID 2782636
(E)-1,2-difluorohex-1-ene
CID 5381415
(Z)-1,2-difluorohex-1-ene
CID 6385325
4,4,5,5,6,6,6-Heptafluorohex-1-ene
CID 12594163
1,1-Difluoropent-1-ene
CID 13087753
(1E)-1-fluoro-1-heptene
CID 22904171
3-Fluorohex-1-ene
CID 23437622
3,3-Difluorohex-1-ene
CID 54512479
Fluorohexene
CID 57359528
cis-1-Fluoro-1-hexene
CID 87950676

Frequently Asked Questions

What is the IUPAC name of 5,5-difluorohex-1-ene?
The IUPAC name of 5,5-difluorohex-1-ene (CID 15828064) is 5,5-difluorohex-1-ene.
What is the SMILES notation for 5,5-difluorohex-1-ene?
The canonical SMILES for 5,5-difluorohex-1-ene is C=CCCC(C)(F)F.
What is the InChIKey of 5,5-difluorohex-1-ene?
The InChIKey is PQBCFPCHDLMXPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F2/c1-3-4-5-6(2,7)8/h3H,1,4-5H2,2H3.
What are the key properties of 5,5-difluorohex-1-ene?
5,5-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 5,5-difluorohex-1-ene is sourced from PubChem (CID 15828064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).