methoxyethane;propane

C6H16O — CID 54435068

IUPACmethoxyethane;propane
SMILESCCC.CCOC
InChIInChI=1S/C3H8O.C3H8/c1-3-4-2;1-3-2/h3H2,1-2H3;3H2,1-2H3
InChIKeyWKDPVJCFZXOXRI-UHFFFAOYSA-N
MW104.19 g/mol
LogP2.07
Rot. Bonds1

About methoxyethane;propane

methoxyethane;propane (PubChem CID 54435068) has the molecular formula C6H16O and a molecular weight of 104.19 g/mol. Its IUPAC name is methoxyethane;propane.

Molecular Properties

Compound Namemethoxyethane;propane
PubChem CID54435068
Molecular FormulaC6H16O
Molecular Weight104.19 g/mol
Exact Mass104.12
IUPAC Namemethoxyethane;propane
SMILESCCC.CCOC
InChIInChI=1S/C3H8O.C3H8/c1-3-4-2;1-3-2/h3H2,1-2H3;3H2,1-2H3
InChIKeyWKDPVJCFZXOXRI-UHFFFAOYSA-N
XLogP2.07
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.19
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Propyl ether
CID 8114
Butyl methyl ether
CID 12338
Methyl propyl ether
CID 11182
Ethyl propyl ether
CID 12340
1-Propoxybutane
CID 137814
3-Ethoxypropyl(dimethyl)stannane
CID 58713847
Methyl propyl ether hydrogen iodide
CID 129684698
3-Methoxypropyl stannane
CID 129868443
Trimethyl(propoxy)germane
CID 85779108
Trimethyl(propoxy)plumbane
CID 86186630
CID 134951808
CID 134951808
(1-Methoxy-3-trimethylstannylpropan-2-yl)-trimethylstannane
CID 21629275

Frequently Asked Questions

What is the IUPAC name of methoxyethane;propane?
The IUPAC name of methoxyethane;propane (CID 54435068) is methoxyethane;propane.
What is the SMILES notation for methoxyethane;propane?
The canonical SMILES for methoxyethane;propane is CCC.CCOC.
What is the InChIKey of methoxyethane;propane?
The InChIKey is WKDPVJCFZXOXRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8O.C3H8/c1-3-4-2;1-3-2/h3H2,1-2H3;3H2,1-2H3.
What are the key properties of methoxyethane;propane?
methoxyethane;propane has a molecular weight of 104.19 g/mol, XLogP of 2.07, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methoxyethane;propane is sourced from PubChem (CID 54435068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).