2-methoxy-2-methylpropane;2-methyloxirane

C8H18O2 — CID 161023674

IUPAC2-methoxy-2-methylpropane;2-methyloxirane
SMILESCC1CO1.COC(C)(C)C
InChIInChI=1S/C5H12O.C3H6O/c1-5(2,3)6-4;1-3-2-4-3/h1-4H3;3H,2H2,1H3
InChIKeyTYSAAJZTICGGFM-UHFFFAOYSA-N
MW146.23 g/mol
LogP1.84
Rot. Bonds

About 2-methoxy-2-methylpropane;2-methyloxirane

2-methoxy-2-methylpropane;2-methyloxirane (PubChem CID 161023674) has the molecular formula C8H18O2 and a molecular weight of 146.23 g/mol. Its IUPAC name is 2-methoxy-2-methylpropane;2-methyloxirane.

Molecular Properties

Compound Name2-methoxy-2-methylpropane;2-methyloxirane
PubChem CID161023674
Molecular FormulaC8H18O2
Molecular Weight146.23 g/mol
Exact Mass146.13
IUPAC Name2-methoxy-2-methylpropane;2-methyloxirane
SMILESCC1CO1.COC(C)(C)C
InChIInChI=1S/C5H12O.C3H6O/c1-5(2,3)6-4;1-3-2-4-3/h1-4H3;3H,2H2,1H3
InChIKeyTYSAAJZTICGGFM-UHFFFAOYSA-N
XLogP1.84
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-2-methylpropane;2-methyloxirane?
The IUPAC name of 2-methoxy-2-methylpropane;2-methyloxirane (CID 161023674) is 2-methoxy-2-methylpropane;2-methyloxirane.
What is the SMILES notation for 2-methoxy-2-methylpropane;2-methyloxirane?
The canonical SMILES for 2-methoxy-2-methylpropane;2-methyloxirane is CC1CO1.COC(C)(C)C.
What is the InChIKey of 2-methoxy-2-methylpropane;2-methyloxirane?
The InChIKey is TYSAAJZTICGGFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12O.C3H6O/c1-5(2,3)6-4;1-3-2-4-3/h1-4H3;3H,2H2,1H3.
What are the key properties of 2-methoxy-2-methylpropane;2-methyloxirane?
2-methoxy-2-methylpropane;2-methyloxirane has a molecular weight of 146.23 g/mol, XLogP of 1.84, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-2-methylpropane;2-methyloxirane is sourced from PubChem (CID 161023674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).