carbon dioxide;formaldehyde;methane

C5H12O4 — CID 159158560

IUPACcarbon dioxide;formaldehyde;methane
SMILESC.C.C=O.C=O.O=C=O
InChIInChI=1S/CO2.2CH2O.2CH4/c2-1-3;2*1-2;;/h;2*1H2;2*1H4
InChIKeyKKEXIJUKDVONNA-UHFFFAOYSA-N
MW136.15 g/mol
LogP0.32
Rot. Bonds

About carbon dioxide;formaldehyde;methane

carbon dioxide;formaldehyde;methane (PubChem CID 159158560) has the molecular formula C5H12O4 and a molecular weight of 136.15 g/mol. Its IUPAC name is carbon dioxide;formaldehyde;methane.

Molecular Properties

Compound Namecarbon dioxide;formaldehyde;methane
PubChem CID159158560
Molecular FormulaC5H12O4
Molecular Weight136.15 g/mol
Exact Mass136.07
IUPAC Namecarbon dioxide;formaldehyde;methane
SMILESC.C.C=O.C=O.O=C=O
InChIInChI=1S/CO2.2CH2O.2CH4/c2-1-3;2*1-2;;/h;2*1H2;2*1H4
InChIKeyKKEXIJUKDVONNA-UHFFFAOYSA-N
XLogP0.32
TPSA68.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.15
LogP ≤ 50.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of carbon dioxide;formaldehyde;methane?
The IUPAC name of carbon dioxide;formaldehyde;methane (CID 159158560) is carbon dioxide;formaldehyde;methane.
What is the SMILES notation for carbon dioxide;formaldehyde;methane?
The canonical SMILES for carbon dioxide;formaldehyde;methane is C.C.C=O.C=O.O=C=O.
What is the InChIKey of carbon dioxide;formaldehyde;methane?
The InChIKey is KKEXIJUKDVONNA-UHFFFAOYSA-N. The full InChI is InChI=1S/CO2.2CH2O.2CH4/c2-1-3;2*1-2;;/h;2*1H2;2*1H4.
What are the key properties of carbon dioxide;formaldehyde;methane?
carbon dioxide;formaldehyde;methane has a molecular weight of 136.15 g/mol, XLogP of 0.32, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for carbon dioxide;formaldehyde;methane is sourced from PubChem (CID 159158560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).