3-methyl-2-(oxetan-3-yl)butan-2-ol

C8H16O2 — CID 176651035

IUPAC3-methyl-2-(oxetan-3-yl)butan-2-ol
SMILESCC(C)C(C)(O)C1COC1
InChIInChI=1S/C8H16O2/c1-6(2)8(3,9)7-4-10-5-7/h6-7,9H,4-5H2,1-3H3
InChIKeyFKGBVRSLFIOEOL-UHFFFAOYSA-N
MW144.21 g/mol
LogP1.04
Rot. Bonds2

About 3-methyl-2-(oxetan-3-yl)butan-2-ol

3-methyl-2-(oxetan-3-yl)butan-2-ol (PubChem CID 176651035) has the molecular formula C8H16O2 and a molecular weight of 144.21 g/mol. Its IUPAC name is 3-methyl-2-(oxetan-3-yl)butan-2-ol.

Molecular Properties

Compound Name3-methyl-2-(oxetan-3-yl)butan-2-ol
PubChem CID176651035
Molecular FormulaC8H16O2
Molecular Weight144.21 g/mol
Exact Mass144.12
IUPAC Name3-methyl-2-(oxetan-3-yl)butan-2-ol
SMILESCC(C)C(C)(O)C1COC1
InChIInChI=1S/C8H16O2/c1-6(2)8(3,9)7-4-10-5-7/h6-7,9H,4-5H2,1-3H3
InChIKeyFKGBVRSLFIOEOL-UHFFFAOYSA-N
XLogP1.04
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.21
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1,9-dioxaspiro[5.5]undecan-4-yl)-3-methylbutan-2-ol
CID 79899451
3,4-dimethyl-2-(oxolan-3-yl)pentan-2-ol
CID 131113950
2,4-dimethyl-3-(oxan-4-yl)pentan-3-ol
CID 126978853
(2S)-2-hydroxy-3-methylbutan-2-olate
CID 59952741
2,3-dimethyl(213C)butan-2-ol
CID 100985919
2-cyclopropyl-3,4-dimethylpentan-2-ol
CID 130647257
4-amino-3-methyl-2-(oxan-4-yl)butan-2-ol
CID 105442753
(2R)-3-methyl-2-[(2S)-pyrrolidin-2-yl]butan-2-ol
CID 138485633
2,3-dimethylbutan-2-ol;titanium
CID 151633599
ethyl 2-methyl-2-(oxetan-3-yl)propanoate
CID 170912678
1-(4-chloro-1-propan-2-ylpyrazol-5-yl)-1-(oxolan-3-yl)ethanol
CID 114638462
2-cyclopropyl-1,1-difluoropropan-2-ol
CID 80610889

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2-(oxetan-3-yl)butan-2-ol?
The IUPAC name of 3-methyl-2-(oxetan-3-yl)butan-2-ol (CID 176651035) is 3-methyl-2-(oxetan-3-yl)butan-2-ol.
What is the SMILES notation for 3-methyl-2-(oxetan-3-yl)butan-2-ol?
The canonical SMILES for 3-methyl-2-(oxetan-3-yl)butan-2-ol is CC(C)C(C)(O)C1COC1.
What is the InChIKey of 3-methyl-2-(oxetan-3-yl)butan-2-ol?
The InChIKey is FKGBVRSLFIOEOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O2/c1-6(2)8(3,9)7-4-10-5-7/h6-7,9H,4-5H2,1-3H3.
What are the key properties of 3-methyl-2-(oxetan-3-yl)butan-2-ol?
3-methyl-2-(oxetan-3-yl)butan-2-ol has a molecular weight of 144.21 g/mol, XLogP of 1.04, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-(oxetan-3-yl)butan-2-ol is sourced from PubChem (CID 176651035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).