2-methoxypropane

C4H10O — CID 11721

IUPAC2-methoxypropane
SMILESCOC(C)C
InChIInChI=1S/C4H10O/c1-4(2)5-3/h4H,1-3H3
InChIKeyRMGHERXMTMUMMV-UHFFFAOYSA-N
MW74.12 g/mol
LogP1.04
Rot. Bonds1

About 2-methoxypropane

2-methoxypropane (PubChem CID 11721) has the molecular formula C4H10O and a molecular weight of 74.12 g/mol. Its IUPAC name is 2-methoxypropane.

Molecular Properties

Compound Name2-methoxypropane
PubChem CID11721
Molecular FormulaC4H10O
Molecular Weight74.12 g/mol
Exact Mass74.07
IUPAC Name2-methoxypropane
SMILESCOC(C)C
InChIInChI=1S/C4H10O/c1-4(2)5-3/h4H,1-3H3
InChIKeyRMGHERXMTMUMMV-UHFFFAOYSA-N
XLogP1.04
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50074.12
LogP ≤ 51.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methoxypropane?
The IUPAC name of 2-methoxypropane (CID 11721) is 2-methoxypropane.
What is the SMILES notation for 2-methoxypropane?
The canonical SMILES for 2-methoxypropane is COC(C)C.
What is the InChIKey of 2-methoxypropane?
The InChIKey is RMGHERXMTMUMMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O/c1-4(2)5-3/h4H,1-3H3.
What are the key properties of 2-methoxypropane?
2-methoxypropane has a molecular weight of 74.12 g/mol, XLogP of 1.04, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxypropane is sourced from PubChem (CID 11721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).