ethane;methanol;propane

C6H18O — CID 91023482

IUPACethane;methanol;propane
SMILESCC.CCC.CO
InChIInChI=1S/C3H8.C2H6.CH4O/c1-3-2;2*1-2/h3H2,1-2H3;1-2H3;2H,1H3
InChIKeyWLHJIVQBHSKRAA-UHFFFAOYSA-N
MW106.21 g/mol
LogP2.05
Rot. Bonds

About ethane;methanol;propane

ethane;methanol;propane (PubChem CID 91023482) has the molecular formula C6H18O and a molecular weight of 106.21 g/mol. Its IUPAC name is ethane;methanol;propane.

Molecular Properties

Compound Nameethane;methanol;propane
PubChem CID91023482
Molecular FormulaC6H18O
Molecular Weight106.21 g/mol
Exact Mass106.14
IUPAC Nameethane;methanol;propane
SMILESCC.CCC.CO
InChIInChI=1S/C3H8.C2H6.CH4O/c1-3-2;2*1-2/h3H2,1-2H3;1-2H3;2H,1H3
InChIKeyWLHJIVQBHSKRAA-UHFFFAOYSA-N
XLogP2.05
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500106.21
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of ethane;methanol;propane?
The IUPAC name of ethane;methanol;propane (CID 91023482) is ethane;methanol;propane.
What is the SMILES notation for ethane;methanol;propane?
The canonical SMILES for ethane;methanol;propane is CC.CCC.CO.
What is the InChIKey of ethane;methanol;propane?
The InChIKey is WLHJIVQBHSKRAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8.C2H6.CH4O/c1-3-2;2*1-2/h3H2,1-2H3;1-2H3;2H,1H3.
What are the key properties of ethane;methanol;propane?
ethane;methanol;propane has a molecular weight of 106.21 g/mol, XLogP of 2.05, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;methanol;propane is sourced from PubChem (CID 91023482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).