methane;oxirane

C3H8O — CID 21257745

IUPACmethane;oxirane
SMILESC.C1CO1
InChIInChI=1S/C2H4O.CH4/c1-2-3-1;/h1-2H2;1H4
InChIKeyZQVOTOSIYOIZNO-UHFFFAOYSA-N
MW60.10 g/mol
LogP0.65
Rot. Bonds

About methane;oxirane

methane;oxirane (PubChem CID 21257745) has the molecular formula C3H8O and a molecular weight of 60.10 g/mol. Its IUPAC name is methane;oxirane.

Molecular Properties

Compound Namemethane;oxirane
PubChem CID21257745
Molecular FormulaC3H8O
Molecular Weight60.10 g/mol
Exact Mass60.06
IUPAC Namemethane;oxirane
SMILESC.C1CO1
InChIInChI=1S/C2H4O.CH4/c1-2-3-1;/h1-2H2;1H4
InChIKeyZQVOTOSIYOIZNO-UHFFFAOYSA-N
XLogP0.65
TPSA12.53 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50060.10
LogP ≤ 50.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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neon;oxirane
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1,4-dioxane
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argon;1,4-dioxane
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1,4-dioxane;stannane
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1,4-dioxane;silver
CID 157261770
potassium;1,4-dioxane;hydroxide
CID 70357034
CID 173231332
CID 173231332
cyclobutane;1,4-dioxane
CID 160886837
1,3,6,8-tetraoxecane
CID 19993864
dilithium;hydride;1,4,7,10,13-pentaoxacyclopentadecane
CID 173287985

Frequently Asked Questions

What is the IUPAC name of methane;oxirane?
The IUPAC name of methane;oxirane (CID 21257745) is methane;oxirane.
What is the SMILES notation for methane;oxirane?
The canonical SMILES for methane;oxirane is C.C1CO1.
What is the InChIKey of methane;oxirane?
The InChIKey is ZQVOTOSIYOIZNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4O.CH4/c1-2-3-1;/h1-2H2;1H4.
What are the key properties of methane;oxirane?
methane;oxirane has a molecular weight of 60.10 g/mol, XLogP of 0.65, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methane;oxirane is sourced from PubChem (CID 21257745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).