ethane

C8H24 — CID 91095070

IUPACethane
SMILESCC.CC.CC.CC
InChIInChI=1S/4C2H6/c4*1-2/h4*1-2H3
InChIKeyVYOXYQYMMWGNSM-UHFFFAOYSA-N
MW120.28 g/mol
LogP4.10
Rot. Bonds

About ethane

ethane (PubChem CID 91095070) has the molecular formula C8H24 and a molecular weight of 120.28 g/mol. Its IUPAC name is ethane.

Molecular Properties

Compound Nameethane
PubChem CID91095070
Molecular FormulaC8H24
Molecular Weight120.28 g/mol
Exact Mass120.19
IUPAC Nameethane
SMILESCC.CC.CC.CC
InChIInChI=1S/4C2H6/c4*1-2/h4*1-2H3
InChIKeyVYOXYQYMMWGNSM-UHFFFAOYSA-N
XLogP4.10
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.28
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of ethane?
The IUPAC name of ethane (CID 91095070) is ethane.
What is the SMILES notation for ethane?
The canonical SMILES for ethane is CC.CC.CC.CC.
What is the InChIKey of ethane?
The InChIKey is VYOXYQYMMWGNSM-UHFFFAOYSA-N. The full InChI is InChI=1S/4C2H6/c4*1-2/h4*1-2H3.
What are the key properties of ethane?
ethane has a molecular weight of 120.28 g/mol, XLogP of 4.10, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane is sourced from PubChem (CID 91095070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).