6,6-difluoro-4,4-dimethylhex-1-ene

C8H14F2 — CID 176961895

IUPAC6,6-difluoro-4,4-dimethylhex-1-ene
SMILESC=CCC(C)(C)CC(F)F
InChIInChI=1S/C8H14F2/c1-4-5-8(2,3)6-7(9)10/h4,7H,1,5-6H2,2-3H3
InChIKeyBVEIPTAFDWABCY-UHFFFAOYSA-N
MW148.20 g/mol
LogP3.24
Rot. Bonds4

About 6,6-difluoro-4,4-dimethylhex-1-ene

6,6-difluoro-4,4-dimethylhex-1-ene (PubChem CID 176961895) has the molecular formula C8H14F2 and a molecular weight of 148.20 g/mol. Its IUPAC name is 6,6-difluoro-4,4-dimethylhex-1-ene.

Molecular Properties

Compound Name6,6-difluoro-4,4-dimethylhex-1-ene
PubChem CID176961895
Molecular FormulaC8H14F2
Molecular Weight148.20 g/mol
Exact Mass148.11
IUPAC Name6,6-difluoro-4,4-dimethylhex-1-ene
SMILESC=CCC(C)(C)CC(F)F
InChIInChI=1S/C8H14F2/c1-4-5-8(2,3)6-7(9)10/h4,7H,1,5-6H2,2-3H3
InChIKeyBVEIPTAFDWABCY-UHFFFAOYSA-N
XLogP3.24
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.20
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6,6-difluoro-4,4-dimethylhex-1-ene?
The IUPAC name of 6,6-difluoro-4,4-dimethylhex-1-ene (CID 176961895) is 6,6-difluoro-4,4-dimethylhex-1-ene.
What is the SMILES notation for 6,6-difluoro-4,4-dimethylhex-1-ene?
The canonical SMILES for 6,6-difluoro-4,4-dimethylhex-1-ene is C=CCC(C)(C)CC(F)F.
What is the InChIKey of 6,6-difluoro-4,4-dimethylhex-1-ene?
The InChIKey is BVEIPTAFDWABCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F2/c1-4-5-8(2,3)6-7(9)10/h4,7H,1,5-6H2,2-3H3.
What are the key properties of 6,6-difluoro-4,4-dimethylhex-1-ene?
6,6-difluoro-4,4-dimethylhex-1-ene has a molecular weight of 148.20 g/mol, XLogP of 3.24, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6-difluoro-4,4-dimethylhex-1-ene is sourced from PubChem (CID 176961895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).