ethane;methoxymethane

C4H12O — CID 54573551

IUPACethane;methoxymethane
SMILESCC.COC
InChIInChI=1S/C2H6O.C2H6/c1-3-2;1-2/h1-2H3;1-2H3
InChIKeyZYZWGUCKAHQKAI-UHFFFAOYSA-N
MW76.14 g/mol
LogP1.29
Rot. Bonds

About ethane;methoxymethane

ethane;methoxymethane (PubChem CID 54573551) has the molecular formula C4H12O and a molecular weight of 76.14 g/mol. Its IUPAC name is ethane;methoxymethane.

Molecular Properties

Compound Nameethane;methoxymethane
PubChem CID54573551
Molecular FormulaC4H12O
Molecular Weight76.14 g/mol
Exact Mass76.09
IUPAC Nameethane;methoxymethane
SMILESCC.COC
InChIInChI=1S/C2H6O.C2H6/c1-3-2;1-2/h1-2H3;1-2H3
InChIKeyZYZWGUCKAHQKAI-UHFFFAOYSA-N
XLogP1.29
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50076.14
LogP ≤ 51.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of ethane;methoxymethane?
The IUPAC name of ethane;methoxymethane (CID 54573551) is ethane;methoxymethane.
What is the SMILES notation for ethane;methoxymethane?
The canonical SMILES for ethane;methoxymethane is CC.COC.
What is the InChIKey of ethane;methoxymethane?
The InChIKey is ZYZWGUCKAHQKAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6O.C2H6/c1-3-2;1-2/h1-2H3;1-2H3.
What are the key properties of ethane;methoxymethane?
ethane;methoxymethane has a molecular weight of 76.14 g/mol, XLogP of 1.29, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;methoxymethane is sourced from PubChem (CID 54573551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).