6,6,6-trifluoro-2-methylhex-2-ene

C7H11F3 — CID 19936152

IUPAC6,6,6-trifluoro-2-methylhex-2-ene
SMILESCC(C)=CCCC(F)(F)F
InChIInChI=1S/C7H11F3/c1-6(2)4-3-5-7(8,9)10/h4H,3,5H2,1-2H3
InChIKeyVKSCZPIDMBUBPZ-UHFFFAOYSA-N
MW152.16 g/mol
LogP3.30
Rot. Bonds2

About 6,6,6-trifluoro-2-methylhex-2-ene

6,6,6-trifluoro-2-methylhex-2-ene (PubChem CID 19936152) has the molecular formula C7H11F3 and a molecular weight of 152.16 g/mol. Its IUPAC name is 6,6,6-trifluoro-2-methylhex-2-ene.

Molecular Properties

Compound Name6,6,6-trifluoro-2-methylhex-2-ene
PubChem CID19936152
Molecular FormulaC7H11F3
Molecular Weight152.16 g/mol
Exact Mass152.08
IUPAC Name6,6,6-trifluoro-2-methylhex-2-ene
SMILESCC(C)=CCCC(F)(F)F
InChIInChI=1S/C7H11F3/c1-6(2)4-3-5-7(8,9)10/h4H,3,5H2,1-2H3
InChIKeyVKSCZPIDMBUBPZ-UHFFFAOYSA-N
XLogP3.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.16
LogP ≤ 53.30
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

5,5,6,6,7,7,8,8,8-Nonafluoro-2-methyloct-2-ene
CID 71331659
5,6,6,7,7,8,8,8-Octafluoro-2-methylocta-2,4-diene
CID 71429349
1,1,1,2,2,3,3,4,4-Nonafluoro-5-methylundec-5-ene
CID 85549144
1,1,1-Trifluoro-2-heptene
CID 2782636
(6E)-9,9,9-trifluoro-2,6-dimethylnona-2,6-diene
CID 12519453
(E)-5,5-difluoropent-2-ene
CID 13356676
5,5-Difluoro-2-methylpent-2-ene
CID 14092768
5,5,5-Trifluoro-2-methylpent-2-ene
CID 53930878
4-Methyl-2-trifluoromethylpentadiene
CID 90166011
4-Fluoro-3-methylpent-2-ene
CID 123511146
(E)-3-Fluoro-4-methylhexa-1,4-dien
CID 132280137
4-Ethyl-1,1,1-trifluoro-3-hexene
CID 14400284

Frequently Asked Questions

What is the IUPAC name of 6,6,6-trifluoro-2-methylhex-2-ene?
The IUPAC name of 6,6,6-trifluoro-2-methylhex-2-ene (CID 19936152) is 6,6,6-trifluoro-2-methylhex-2-ene.
What is the SMILES notation for 6,6,6-trifluoro-2-methylhex-2-ene?
The canonical SMILES for 6,6,6-trifluoro-2-methylhex-2-ene is CC(C)=CCCC(F)(F)F.
What is the InChIKey of 6,6,6-trifluoro-2-methylhex-2-ene?
The InChIKey is VKSCZPIDMBUBPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F3/c1-6(2)4-3-5-7(8,9)10/h4H,3,5H2,1-2H3.
What are the key properties of 6,6,6-trifluoro-2-methylhex-2-ene?
6,6,6-trifluoro-2-methylhex-2-ene has a molecular weight of 152.16 g/mol, XLogP of 3.30, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6,6-trifluoro-2-methylhex-2-ene is sourced from PubChem (CID 19936152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).