(1R,2R,3S,4S)-1,2,3,4-tetrafluorocyclohexane

C6H8F4 — CID 23234325

IUPAC(1R,2R,3S,4S)-1,2,3,4-tetrafluorocyclohexane
SMILESF[C@@H]1[C@H](F)[C@H](F)CC[C@@H]1F
InChIInChI=1S/C6H8F4/c7-3-1-2-4(8)6(10)5(3)9/h3-6H,1-2H2/t3-,4+,5-,6+
InChIKeyOXEMDXFZNSLHBB-FBXFSONDSA-N
MW156.12 g/mol
LogP2.13
Rot. Bonds

About (1R,2R,3S,4S)-1,2,3,4-tetrafluorocyclohexane

(1R,2R,3S,4S)-1,2,3,4-tetrafluorocyclohexane (PubChem CID 23234325) has the molecular formula C6H8F4 and a molecular weight of 156.12 g/mol. Its IUPAC name is (1R,2R,3S,4S)-1,2,3,4-tetrafluorocyclohexane.

Molecular Properties

Compound Name(1R,2R,3S,4S)-1,2,3,4-tetrafluorocyclohexane
PubChem CID23234325
Molecular FormulaC6H8F4
Molecular Weight156.12 g/mol
Exact Mass156.06
IUPAC Name(1R,2R,3S,4S)-1,2,3,4-tetrafluorocyclohexane
SMILESF[C@@H]1[C@H](F)[C@H](F)CC[C@@H]1F
InChIInChI=1S/C6H8F4/c7-3-1-2-4(8)6(10)5(3)9/h3-6H,1-2H2/t3-,4+,5-,6+
InChIKeyOXEMDXFZNSLHBB-FBXFSONDSA-N
XLogP2.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.12
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze (1R,2R,3S,4S)-1,2,3,4-tetrafluorocyclohexane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (1R,2R,3S,4S)-1,2,3,4-tetrafluorocyclohexane?
The IUPAC name of (1R,2R,3S,4S)-1,2,3,4-tetrafluorocyclohexane (CID 23234325) is (1R,2R,3S,4S)-1,2,3,4-tetrafluorocyclohexane.
What is the SMILES notation for (1R,2R,3S,4S)-1,2,3,4-tetrafluorocyclohexane?
The canonical SMILES for (1R,2R,3S,4S)-1,2,3,4-tetrafluorocyclohexane is F[C@@H]1[C@H](F)[C@H](F)CC[C@@H]1F.
What is the InChIKey of (1R,2R,3S,4S)-1,2,3,4-tetrafluorocyclohexane?
The InChIKey is OXEMDXFZNSLHBB-FBXFSONDSA-N. The full InChI is InChI=1S/C6H8F4/c7-3-1-2-4(8)6(10)5(3)9/h3-6H,1-2H2/t3-,4+,5-,6+.
What are the key properties of (1R,2R,3S,4S)-1,2,3,4-tetrafluorocyclohexane?
(1R,2R,3S,4S)-1,2,3,4-tetrafluorocyclohexane has a molecular weight of 156.12 g/mol, XLogP of 2.13, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2R,3S,4S)-1,2,3,4-tetrafluorocyclohexane is sourced from PubChem (CID 23234325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).