methane;2-methylpropane;oxetane

C8H20O — CID 160642963

IUPACmethane;2-methylpropane;oxetane
SMILESC.C1COC1.CC(C)C
InChIInChI=1S/C4H10.C3H6O.CH4/c1-4(2)3;1-2-4-3-1;/h4H,1-3H3;1-3H2;1H4
InChIKeyRJKOEKLPNAUSMH-UHFFFAOYSA-N
MW132.25 g/mol
LogP2.71
Rot. Bonds

About methane;2-methylpropane;oxetane

methane;2-methylpropane;oxetane (PubChem CID 160642963) has the molecular formula C8H20O and a molecular weight of 132.25 g/mol. Its IUPAC name is methane;2-methylpropane;oxetane.

Molecular Properties

Compound Namemethane;2-methylpropane;oxetane
PubChem CID160642963
Molecular FormulaC8H20O
Molecular Weight132.25 g/mol
Exact Mass132.15
IUPAC Namemethane;2-methylpropane;oxetane
SMILESC.C1COC1.CC(C)C
InChIInChI=1S/C4H10.C3H6O.CH4/c1-4(2)3;1-2-4-3-1;/h4H,1-3H3;1-3H2;1H4
InChIKeyRJKOEKLPNAUSMH-UHFFFAOYSA-N
XLogP2.71
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.25
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-methylpropane;oxolane
CID 70603205
2-methylpropane;oxane
CID 91454058
ethane;2-methylpropane;oxane
CID 91157399
cyclobutane;ethane;methane;bis(2-methylpropane)
CID 159966273
2-chloropropane;oxolane
CID 159770837
2,2-di(propan-2-yl)-1,3-dioxane;2,2-di(propan-2-yl)-1,3-dioxolane;methane
CID 158994829
bis(1,4-dioxane);N-propan-2-ylpropan-2-amine
CID 158831625
oxolane;propan-2-ol
CID 22597222
oxirane;propan-2-amine
CID 163631422
2-propan-2-yl-1,3,2-dioxaborinane
CID 5326212
tetrakis(2-methylpropane);oxane;oxolane;thiane;thiolane
CID 161150896
methane;oxirane
CID 21257745

Frequently Asked Questions

What is the IUPAC name of methane;2-methylpropane;oxetane?
The IUPAC name of methane;2-methylpropane;oxetane (CID 160642963) is methane;2-methylpropane;oxetane.
What is the SMILES notation for methane;2-methylpropane;oxetane?
The canonical SMILES for methane;2-methylpropane;oxetane is C.C1COC1.CC(C)C.
What is the InChIKey of methane;2-methylpropane;oxetane?
The InChIKey is RJKOEKLPNAUSMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10.C3H6O.CH4/c1-4(2)3;1-2-4-3-1;/h4H,1-3H3;1-3H2;1H4.
What are the key properties of methane;2-methylpropane;oxetane?
methane;2-methylpropane;oxetane has a molecular weight of 132.25 g/mol, XLogP of 2.71, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methane;2-methylpropane;oxetane is sourced from PubChem (CID 160642963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).