1,1-difluoropentane

C5H10F2 — CID 18967887

IUPAC1,1-difluoropentane
SMILESCCCCC(F)F
InChIInChI=1S/C5H10F2/c1-2-3-4-5(6)7/h5H,2-4H2,1H3
InChIKeyPSSHQAXMSKKIBE-UHFFFAOYSA-N
MW108.13 g/mol
LogP2.44
Rot. Bonds3

About 1,1-difluoropentane

1,1-difluoropentane (PubChem CID 18967887) has the molecular formula C5H10F2 and a molecular weight of 108.13 g/mol. Its IUPAC name is 1,1-difluoropentane.

Molecular Properties

Compound Name1,1-difluoropentane
PubChem CID18967887
Molecular FormulaC5H10F2
Molecular Weight108.13 g/mol
Exact Mass108.08
IUPAC Name1,1-difluoropentane
SMILESCCCCC(F)F
InChIInChI=1S/C5H10F2/c1-2-3-4-5(6)7/h5H,2-4H2,1H3
InChIKeyPSSHQAXMSKKIBE-UHFFFAOYSA-N
XLogP2.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.13
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,1-difluoropentane?
The IUPAC name of 1,1-difluoropentane (CID 18967887) is 1,1-difluoropentane.
What is the SMILES notation for 1,1-difluoropentane?
The canonical SMILES for 1,1-difluoropentane is CCCCC(F)F.
What is the InChIKey of 1,1-difluoropentane?
The InChIKey is PSSHQAXMSKKIBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10F2/c1-2-3-4-5(6)7/h5H,2-4H2,1H3.
What are the key properties of 1,1-difluoropentane?
1,1-difluoropentane has a molecular weight of 108.13 g/mol, XLogP of 2.44, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-difluoropentane is sourced from PubChem (CID 18967887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).