2,2-difluoro-3-methylbutane

C5H10F2 — CID 11147680

IUPAC2,2-difluoro-3-methylbutane
SMILESCC(C)C(C)(F)F
InChIInChI=1S/C5H10F2/c1-4(2)5(3,6)7/h4H,1-3H3
InChIKeyWTFQLRFJNHTEIC-UHFFFAOYSA-N
MW108.13 g/mol
LogP2.30
Rot. Bonds1

About 2,2-difluoro-3-methylbutane

2,2-difluoro-3-methylbutane (PubChem CID 11147680) has the molecular formula C5H10F2 and a molecular weight of 108.13 g/mol. Its IUPAC name is 2,2-difluoro-3-methylbutane.

Molecular Properties

Compound Name2,2-difluoro-3-methylbutane
PubChem CID11147680
Molecular FormulaC5H10F2
Molecular Weight108.13 g/mol
Exact Mass108.08
IUPAC Name2,2-difluoro-3-methylbutane
SMILESCC(C)C(C)(F)F
InChIInChI=1S/C5H10F2/c1-4(2)5(3,6)7/h4H,1-3H3
InChIKeyWTFQLRFJNHTEIC-UHFFFAOYSA-N
XLogP2.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.13
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-3-methylbutane?
The IUPAC name of 2,2-difluoro-3-methylbutane (CID 11147680) is 2,2-difluoro-3-methylbutane.
What is the SMILES notation for 2,2-difluoro-3-methylbutane?
The canonical SMILES for 2,2-difluoro-3-methylbutane is CC(C)C(C)(F)F.
What is the InChIKey of 2,2-difluoro-3-methylbutane?
The InChIKey is WTFQLRFJNHTEIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10F2/c1-4(2)5(3,6)7/h4H,1-3H3.
What are the key properties of 2,2-difluoro-3-methylbutane?
2,2-difluoro-3-methylbutane has a molecular weight of 108.13 g/mol, XLogP of 2.30, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-3-methylbutane is sourced from PubChem (CID 11147680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).