methoxymethane;4-propyloctane

C13H30O — CID 168881414

IUPACmethoxymethane;4-propyloctane
SMILESCCCCC(CCC)CCC.COC
InChIInChI=1S/C11H24.C2H6O/c1-4-7-10-11(8-5-2)9-6-3;1-3-2/h11H,4-10H2,1-3H3;1-2H3
InChIKeyQFQIOCGKLFEXHC-UHFFFAOYSA-N
MW202.38 g/mol
LogP4.66
Rot. Bonds7

About methoxymethane;4-propyloctane

methoxymethane;4-propyloctane (PubChem CID 168881414) has the molecular formula C13H30O and a molecular weight of 202.38 g/mol. Its IUPAC name is methoxymethane;4-propyloctane.

Molecular Properties

Compound Namemethoxymethane;4-propyloctane
PubChem CID168881414
Molecular FormulaC13H30O
Molecular Weight202.38 g/mol
Exact Mass202.23
IUPAC Namemethoxymethane;4-propyloctane
SMILESCCCCC(CCC)CCC.COC
InChIInChI=1S/C11H24.C2H6O/c1-4-7-10-11(8-5-2)9-6-3;1-3-2/h11H,4-10H2,1-3H3;1-2H3
InChIKeyQFQIOCGKLFEXHC-UHFFFAOYSA-N
XLogP4.66
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.38
LogP ≤ 54.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of methoxymethane;4-propyloctane?
The IUPAC name of methoxymethane;4-propyloctane (CID 168881414) is methoxymethane;4-propyloctane.
What is the SMILES notation for methoxymethane;4-propyloctane?
The canonical SMILES for methoxymethane;4-propyloctane is CCCCC(CCC)CCC.COC.
What is the InChIKey of methoxymethane;4-propyloctane?
The InChIKey is QFQIOCGKLFEXHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24.C2H6O/c1-4-7-10-11(8-5-2)9-6-3;1-3-2/h11H,4-10H2,1-3H3;1-2H3.
What are the key properties of methoxymethane;4-propyloctane?
methoxymethane;4-propyloctane has a molecular weight of 202.38 g/mol, XLogP of 4.66, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methoxymethane;4-propyloctane is sourced from PubChem (CID 168881414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).