(3-hydroxy-2,3-dimethylbutan-2-yl) hypofluorite

C6H13FO2 — CID 152989178

IUPAC(3-hydroxy-2,3-dimethylbutan-2-yl) hypofluorite
SMILESCC(C)(O)C(C)(C)OF
InChIInChI=1S/C6H13FO2/c1-5(2,8)6(3,4)9-7/h8H,1-4H3
InChIKeyUVXVKAKMKIEGBB-UHFFFAOYSA-N
MW136.17 g/mol
LogP1.44
Rot. Bonds2

About (3-hydroxy-2,3-dimethylbutan-2-yl) hypofluorite

(3-hydroxy-2,3-dimethylbutan-2-yl) hypofluorite (PubChem CID 152989178) has the molecular formula C6H13FO2 and a molecular weight of 136.17 g/mol. Its IUPAC name is (3-hydroxy-2,3-dimethylbutan-2-yl) hypofluorite.

Molecular Properties

Compound Name(3-hydroxy-2,3-dimethylbutan-2-yl) hypofluorite
PubChem CID152989178
Molecular FormulaC6H13FO2
Molecular Weight136.17 g/mol
Exact Mass136.09
IUPAC Name(3-hydroxy-2,3-dimethylbutan-2-yl) hypofluorite
SMILESCC(C)(O)C(C)(C)OF
InChIInChI=1S/C6H13FO2/c1-5(2,8)6(3,4)9-7/h8H,1-4H3
InChIKeyUVXVKAKMKIEGBB-UHFFFAOYSA-N
XLogP1.44
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.17
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (3-hydroxy-2,3-dimethylbutan-2-yl) hypofluorite with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3-hydroxy-2,3-dimethylbutan-2-yl) hypofluorite?
The IUPAC name of (3-hydroxy-2,3-dimethylbutan-2-yl) hypofluorite (CID 152989178) is (3-hydroxy-2,3-dimethylbutan-2-yl) hypofluorite.
What is the SMILES notation for (3-hydroxy-2,3-dimethylbutan-2-yl) hypofluorite?
The canonical SMILES for (3-hydroxy-2,3-dimethylbutan-2-yl) hypofluorite is CC(C)(O)C(C)(C)OF.
What is the InChIKey of (3-hydroxy-2,3-dimethylbutan-2-yl) hypofluorite?
The InChIKey is UVXVKAKMKIEGBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13FO2/c1-5(2,8)6(3,4)9-7/h8H,1-4H3.
What are the key properties of (3-hydroxy-2,3-dimethylbutan-2-yl) hypofluorite?
(3-hydroxy-2,3-dimethylbutan-2-yl) hypofluorite has a molecular weight of 136.17 g/mol, XLogP of 1.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-hydroxy-2,3-dimethylbutan-2-yl) hypofluorite is sourced from PubChem (CID 152989178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).