ethane;methane;propane

C26H82 — CID 158640727

IUPACethane;methane;propane
SMILESC.C.C.C.C.CC.CC.CC.CC.CC.CC.CC.CC.CC.CCC
InChIInChI=1S/C3H8.9C2H6.5CH4/c1-3-2;9*1-2;;;;;/h3H2,1-2H3;9*1-2H3;5*1H4
InChIKeyIAIQUKSPZWRVMH-UHFFFAOYSA-N
MW394.94 g/mol
LogP13.83
Rot. Bonds

About ethane;methane;propane

ethane;methane;propane (PubChem CID 158640727) has the molecular formula C26H82 and a molecular weight of 394.94 g/mol. Its IUPAC name is ethane;methane;propane.

Molecular Properties

Compound Nameethane;methane;propane
PubChem CID158640727
Molecular FormulaC26H82
Molecular Weight394.94 g/mol
Exact Mass394.64
IUPAC Nameethane;methane;propane
SMILESC.C.C.C.C.CC.CC.CC.CC.CC.CC.CC.CC.CC.CCC
InChIInChI=1S/C3H8.9C2H6.5CH4/c1-3-2;9*1-2;;;;;/h3H2,1-2H3;9*1-2H3;5*1H4
InChIKeyIAIQUKSPZWRVMH-UHFFFAOYSA-N
XLogP13.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.94
LogP ≤ 513.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of ethane;methane;propane?
The IUPAC name of ethane;methane;propane (CID 158640727) is ethane;methane;propane.
What is the SMILES notation for ethane;methane;propane?
The canonical SMILES for ethane;methane;propane is C.C.C.C.C.CC.CC.CC.CC.CC.CC.CC.CC.CC.CCC.
What is the InChIKey of ethane;methane;propane?
The InChIKey is IAIQUKSPZWRVMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8.9C2H6.5CH4/c1-3-2;9*1-2;;;;;/h3H2,1-2H3;9*1-2H3;5*1H4.
What are the key properties of ethane;methane;propane?
ethane;methane;propane has a molecular weight of 394.94 g/mol, XLogP of 13.83, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;methane;propane is sourced from PubChem (CID 158640727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).