2-fluoro-2-methylbutane

C5H10F- — CID 91065195

IUPAC2-fluoro-2-methylbutane
SMILESC[CH-]C(C)(C)F
InChIInChI=1S/C5H10F/c1-4-5(2,3)6/h4H,1-3H3/q-1
InChIKeyTZMCGGZDXVZZEL-UHFFFAOYSA-N
MW89.13 g/mol
LogP1.96
Rot. Bonds1

About 2-fluoro-2-methylbutane

2-fluoro-2-methylbutane (PubChem CID 91065195) has the molecular formula C5H10F- and a molecular weight of 89.13 g/mol. Its IUPAC name is 2-fluoro-2-methylbutane.

Molecular Properties

Compound Name2-fluoro-2-methylbutane
PubChem CID91065195
Molecular FormulaC5H10F-
Molecular Weight89.13 g/mol
Exact Mass89.08
IUPAC Name2-fluoro-2-methylbutane
SMILESC[CH-]C(C)(C)F
InChIInChI=1S/C5H10F/c1-4-5(2,3)6/h4H,1-3H3/q-1
InChIKeyTZMCGGZDXVZZEL-UHFFFAOYSA-N
XLogP1.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50089.13
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-methylbutane?
The IUPAC name of 2-fluoro-2-methylbutane (CID 91065195) is 2-fluoro-2-methylbutane.
What is the SMILES notation for 2-fluoro-2-methylbutane?
The canonical SMILES for 2-fluoro-2-methylbutane is C[CH-]C(C)(C)F.
What is the InChIKey of 2-fluoro-2-methylbutane?
The InChIKey is TZMCGGZDXVZZEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10F/c1-4-5(2,3)6/h4H,1-3H3/q-1.
What are the key properties of 2-fluoro-2-methylbutane?
2-fluoro-2-methylbutane has a molecular weight of 89.13 g/mol, XLogP of 1.96, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-methylbutane is sourced from PubChem (CID 91065195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).