1-(1,1,2,3,3,3-hexafluoropropyl)cyclohexene

C9H10F6 — CID 10847151

IUPAC1-(1,1,2,3,3,3-hexafluoropropyl)cyclohexene
SMILESFC(C(F)(F)F)C(F)(F)C1=CCCCC1
InChIInChI=1S/C9H10F6/c10-7(9(13,14)15)8(11,12)6-4-2-1-3-5-6/h4,7H,1-3,5H2
InChIKeyMUWZJNVLYTWDAP-UHFFFAOYSA-N
MW232.17 g/mol
LogP4.02
Rot. Bonds2

About 1-(1,1,2,3,3,3-hexafluoropropyl)cyclohexene

1-(1,1,2,3,3,3-hexafluoropropyl)cyclohexene (PubChem CID 10847151) has the molecular formula C9H10F6 and a molecular weight of 232.17 g/mol. Its IUPAC name is 1-(1,1,2,3,3,3-hexafluoropropyl)cyclohexene.

Molecular Properties

Compound Name1-(1,1,2,3,3,3-hexafluoropropyl)cyclohexene
PubChem CID10847151
Molecular FormulaC9H10F6
Molecular Weight232.17 g/mol
Exact Mass232.07
IUPAC Name1-(1,1,2,3,3,3-hexafluoropropyl)cyclohexene
SMILESFC(C(F)(F)F)C(F)(F)C1=CCCCC1
InChIInChI=1S/C9H10F6/c10-7(9(13,14)15)8(11,12)6-4-2-1-3-5-6/h4,7H,1-3,5H2
InChIKeyMUWZJNVLYTWDAP-UHFFFAOYSA-N
XLogP4.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.17
LogP ≤ 54.02
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 1-(1,1,2,3,3,3-hexafluoropropyl)cyclohexene?
The IUPAC name of 1-(1,1,2,3,3,3-hexafluoropropyl)cyclohexene (CID 10847151) is 1-(1,1,2,3,3,3-hexafluoropropyl)cyclohexene.
What is the SMILES notation for 1-(1,1,2,3,3,3-hexafluoropropyl)cyclohexene?
The canonical SMILES for 1-(1,1,2,3,3,3-hexafluoropropyl)cyclohexene is FC(C(F)(F)F)C(F)(F)C1=CCCCC1.
What is the InChIKey of 1-(1,1,2,3,3,3-hexafluoropropyl)cyclohexene?
The InChIKey is MUWZJNVLYTWDAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F6/c10-7(9(13,14)15)8(11,12)6-4-2-1-3-5-6/h4,7H,1-3,5H2.
What are the key properties of 1-(1,1,2,3,3,3-hexafluoropropyl)cyclohexene?
1-(1,1,2,3,3,3-hexafluoropropyl)cyclohexene has a molecular weight of 232.17 g/mol, XLogP of 4.02, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,1,2,3,3,3-hexafluoropropyl)cyclohexene is sourced from PubChem (CID 10847151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).