ethane;methane

C71H228 — CID 162236350

IUPACethane;methane
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC
InChIInChI=1S/28C2H6.15CH4/c28*1-2;;;;;;;;;;;;;;;/h28*1-2H3;15*1H4
InChIKeyZWCOFVZVXQVKSE-UHFFFAOYSA-N
MW1082.60 g/mol
LogP38.28
Rot. Bonds

About ethane;methane

ethane;methane (PubChem CID 162236350) has the molecular formula C71H228 and a molecular weight of 1082.60 g/mol. Its IUPAC name is ethane;methane.

Molecular Properties

Compound Nameethane;methane
PubChem CID162236350
Molecular FormulaC71H228
Molecular Weight1082.60 g/mol
Exact Mass1081.78
IUPAC Nameethane;methane
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC
InChIInChI=1S/28C2H6.15CH4/c28*1-2;;;;;;;;;;;;;;;/h28*1-2H3;15*1H4
InChIKeyZWCOFVZVXQVKSE-UHFFFAOYSA-N
XLogP38.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms71
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001082.60
LogP ≤ 538.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of ethane;methane?
The IUPAC name of ethane;methane (CID 162236350) is ethane;methane.
What is the SMILES notation for ethane;methane?
The canonical SMILES for ethane;methane is C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.
What is the InChIKey of ethane;methane?
The InChIKey is ZWCOFVZVXQVKSE-UHFFFAOYSA-N. The full InChI is InChI=1S/28C2H6.15CH4/c28*1-2;;;;;;;;;;;;;;;/h28*1-2H3;15*1H4.
What are the key properties of ethane;methane?
ethane;methane has a molecular weight of 1082.60 g/mol, XLogP of 38.28, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;methane is sourced from PubChem (CID 162236350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).