3-fluoropropylcyclohexane

C9H17F — CID 11469137

IUPAC3-fluoropropylcyclohexane
SMILESFCCCC1CCCCC1
InChIInChI=1S/C9H17F/c10-8-4-7-9-5-2-1-3-6-9/h9H,1-8H2
InChIKeyPOLPIGVTBCQYSK-UHFFFAOYSA-N
MW144.23 g/mol
LogP3.32
Rot. Bonds3

About 3-fluoropropylcyclohexane

3-fluoropropylcyclohexane (PubChem CID 11469137) has the molecular formula C9H17F and a molecular weight of 144.23 g/mol. Its IUPAC name is 3-fluoropropylcyclohexane.

Molecular Properties

Compound Name3-fluoropropylcyclohexane
PubChem CID11469137
Molecular FormulaC9H17F
Molecular Weight144.23 g/mol
Exact Mass144.13
IUPAC Name3-fluoropropylcyclohexane
SMILESFCCCC1CCCCC1
InChIInChI=1S/C9H17F/c10-8-4-7-9-5-2-1-3-6-9/h9H,1-8H2
InChIKeyPOLPIGVTBCQYSK-UHFFFAOYSA-N
XLogP3.32
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.23
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 3-fluoropropylcyclohexane?
The IUPAC name of 3-fluoropropylcyclohexane (CID 11469137) is 3-fluoropropylcyclohexane.
What is the SMILES notation for 3-fluoropropylcyclohexane?
The canonical SMILES for 3-fluoropropylcyclohexane is FCCCC1CCCCC1.
What is the InChIKey of 3-fluoropropylcyclohexane?
The InChIKey is POLPIGVTBCQYSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17F/c10-8-4-7-9-5-2-1-3-6-9/h9H,1-8H2.
What are the key properties of 3-fluoropropylcyclohexane?
3-fluoropropylcyclohexane has a molecular weight of 144.23 g/mol, XLogP of 3.32, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoropropylcyclohexane is sourced from PubChem (CID 11469137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).