acetic acid;carbon dioxide;ethane;methane

C8H20O4 — CID 159582248

IUPACacetic acid;carbon dioxide;ethane;methane
SMILESC.CC.CC.CC(=O)O.O=C=O
InChIInChI=1S/C2H4O2.2C2H6.CO2.CH4/c1-2(3)4;2*1-2;2-1-3;/h1H3,(H,3,4);2*1-2H3;;1H4
InChIKeyZGRZGZDBEOSLKV-UHFFFAOYSA-N
MW180.24 g/mol
LogP2.20
Rot. Bonds

About acetic acid;carbon dioxide;ethane;methane

acetic acid;carbon dioxide;ethane;methane (PubChem CID 159582248) has the molecular formula C8H20O4 and a molecular weight of 180.24 g/mol. Its IUPAC name is acetic acid;carbon dioxide;ethane;methane.

Molecular Properties

Compound Nameacetic acid;carbon dioxide;ethane;methane
PubChem CID159582248
Molecular FormulaC8H20O4
Molecular Weight180.24 g/mol
Exact Mass180.14
IUPAC Nameacetic acid;carbon dioxide;ethane;methane
SMILESC.CC.CC.CC(=O)O.O=C=O
InChIInChI=1S/C2H4O2.2C2H6.CO2.CH4/c1-2(3)4;2*1-2;2-1-3;/h1H3,(H,3,4);2*1-2H3;;1H4
InChIKeyZGRZGZDBEOSLKV-UHFFFAOYSA-N
XLogP2.20
TPSA71.44 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.24
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of acetic acid;carbon dioxide;ethane;methane?
The IUPAC name of acetic acid;carbon dioxide;ethane;methane (CID 159582248) is acetic acid;carbon dioxide;ethane;methane.
What is the SMILES notation for acetic acid;carbon dioxide;ethane;methane?
The canonical SMILES for acetic acid;carbon dioxide;ethane;methane is C.CC.CC.CC(=O)O.O=C=O.
What is the InChIKey of acetic acid;carbon dioxide;ethane;methane?
The InChIKey is ZGRZGZDBEOSLKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4O2.2C2H6.CO2.CH4/c1-2(3)4;2*1-2;2-1-3;/h1H3,(H,3,4);2*1-2H3;;1H4.
What are the key properties of acetic acid;carbon dioxide;ethane;methane?
acetic acid;carbon dioxide;ethane;methane has a molecular weight of 180.24 g/mol, XLogP of 2.20, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for acetic acid;carbon dioxide;ethane;methane is sourced from PubChem (CID 159582248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).