1,1,2,3,3-pentafluoroprop-2-enylcyclohexane

C9H11F5 — CID 10774972

IUPAC1,1,2,3,3-pentafluoroprop-2-enylcyclohexane
SMILESFC(F)=C(F)C(F)(F)C1CCCCC1
InChIInChI=1S/C9H11F5/c10-7(8(11)12)9(13,14)6-4-2-1-3-5-6/h6H,1-5H2
InChIKeyNKZCSVADKOUHKC-UHFFFAOYSA-N
MW214.18 g/mol
LogP4.28
Rot. Bonds2

About 1,1,2,3,3-pentafluoroprop-2-enylcyclohexane

1,1,2,3,3-pentafluoroprop-2-enylcyclohexane (PubChem CID 10774972) has the molecular formula C9H11F5 and a molecular weight of 214.18 g/mol. Its IUPAC name is 1,1,2,3,3-pentafluoroprop-2-enylcyclohexane.

Molecular Properties

Compound Name1,1,2,3,3-pentafluoroprop-2-enylcyclohexane
PubChem CID10774972
Molecular FormulaC9H11F5
Molecular Weight214.18 g/mol
Exact Mass214.08
IUPAC Name1,1,2,3,3-pentafluoroprop-2-enylcyclohexane
SMILESFC(F)=C(F)C(F)(F)C1CCCCC1
InChIInChI=1S/C9H11F5/c10-7(8(11)12)9(13,14)6-4-2-1-3-5-6/h6H,1-5H2
InChIKeyNKZCSVADKOUHKC-UHFFFAOYSA-N
XLogP4.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.18
LogP ≤ 54.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,1,2,3,3-pentafluoroprop-2-enylcyclohexane?
The IUPAC name of 1,1,2,3,3-pentafluoroprop-2-enylcyclohexane (CID 10774972) is 1,1,2,3,3-pentafluoroprop-2-enylcyclohexane.
What is the SMILES notation for 1,1,2,3,3-pentafluoroprop-2-enylcyclohexane?
The canonical SMILES for 1,1,2,3,3-pentafluoroprop-2-enylcyclohexane is FC(F)=C(F)C(F)(F)C1CCCCC1.
What is the InChIKey of 1,1,2,3,3-pentafluoroprop-2-enylcyclohexane?
The InChIKey is NKZCSVADKOUHKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F5/c10-7(8(11)12)9(13,14)6-4-2-1-3-5-6/h6H,1-5H2.
What are the key properties of 1,1,2,3,3-pentafluoroprop-2-enylcyclohexane?
1,1,2,3,3-pentafluoroprop-2-enylcyclohexane has a molecular weight of 214.18 g/mol, XLogP of 4.28, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,3,3-pentafluoroprop-2-enylcyclohexane is sourced from PubChem (CID 10774972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).