1-(18F)fluoro-2-methylpropane

C4H9F — CID 59445312

IUPAC1-(18F)fluoro-2-methylpropane
SMILESCC(C)C[18F]
InChIInChI=1S/C4H9F/c1-4(2)3-5/h4H,3H2,1-2H3/i5-1
InChIKeyWGCJTTUVWKJDAX-SFIIULIVSA-N
MW75.12 g/mol
LogP1.61
Rot. Bonds1

About 1-(18F)fluoro-2-methylpropane

1-(18F)fluoro-2-methylpropane (PubChem CID 59445312) has the molecular formula C4H9F and a molecular weight of 75.12 g/mol. Its IUPAC name is 1-(18F)fluoro-2-methylpropane.

Molecular Properties

Compound Name1-(18F)fluoro-2-methylpropane
PubChem CID59445312
Molecular FormulaC4H9F
Molecular Weight75.12 g/mol
Exact Mass75.07
IUPAC Name1-(18F)fluoro-2-methylpropane
SMILESCC(C)C[18F]
InChIInChI=1S/C4H9F/c1-4(2)3-5/h4H,3H2,1-2H3/i5-1
InChIKeyWGCJTTUVWKJDAX-SFIIULIVSA-N
XLogP1.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50075.12
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-(18F)fluoro-2-methylpropane?
The IUPAC name of 1-(18F)fluoro-2-methylpropane (CID 59445312) is 1-(18F)fluoro-2-methylpropane.
What is the SMILES notation for 1-(18F)fluoro-2-methylpropane?
The canonical SMILES for 1-(18F)fluoro-2-methylpropane is CC(C)C[18F].
What is the InChIKey of 1-(18F)fluoro-2-methylpropane?
The InChIKey is WGCJTTUVWKJDAX-SFIIULIVSA-N. The full InChI is InChI=1S/C4H9F/c1-4(2)3-5/h4H,3H2,1-2H3/i5-1.
What are the key properties of 1-(18F)fluoro-2-methylpropane?
1-(18F)fluoro-2-methylpropane has a molecular weight of 75.12 g/mol, XLogP of 1.61, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(18F)fluoro-2-methylpropane is sourced from PubChem (CID 59445312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).