deuteriooxymethane;hydron;methane;molecular oxygen;hydrate

C2H11O4+ — CID 160777204

IUPACdeuteriooxymethane;hydron;methane;molecular oxygen;hydrate
SMILESC.O.O=O.[2H]OC.[H+]
InChIInChI=1S/CH4O.CH4.O2.H2O/c1-2;;1-2;/h2H,1H3;1H4;;1H2/p+1/i2D;;;
InChIKeyFXWLLDQGLXWUFD-OZPRGXNDSA-O
MW100.11 g/mol
LogP-0.40
Rot. Bonds

About deuteriooxymethane;hydron;methane;molecular oxygen;hydrate

deuteriooxymethane;hydron;methane;molecular oxygen;hydrate (PubChem CID 160777204) has the molecular formula C2H11O4+ and a molecular weight of 100.11 g/mol. Its IUPAC name is deuteriooxymethane;hydron;methane;molecular oxygen;hydrate.

Molecular Properties

Compound Namedeuteriooxymethane;hydron;methane;molecular oxygen;hydrate
PubChem CID160777204
Molecular FormulaC2H11O4+
Molecular Weight100.11 g/mol
Exact Mass100.07
IUPAC Namedeuteriooxymethane;hydron;methane;molecular oxygen;hydrate
SMILESC.O.O=O.[2H]OC.[H+]
InChIInChI=1S/CH4O.CH4.O2.H2O/c1-2;;1-2;/h2H,1H3;1H4;;1H2/p+1/i2D;;;
InChIKeyFXWLLDQGLXWUFD-OZPRGXNDSA-O
XLogP-0.40
TPSA85.87 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.11
LogP ≤ 5-0.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of deuteriooxymethane;hydron;methane;molecular oxygen;hydrate?
The IUPAC name of deuteriooxymethane;hydron;methane;molecular oxygen;hydrate (CID 160777204) is deuteriooxymethane;hydron;methane;molecular oxygen;hydrate.
What is the SMILES notation for deuteriooxymethane;hydron;methane;molecular oxygen;hydrate?
The canonical SMILES for deuteriooxymethane;hydron;methane;molecular oxygen;hydrate is C.O.O=O.[2H]OC.[H+].
What is the InChIKey of deuteriooxymethane;hydron;methane;molecular oxygen;hydrate?
The InChIKey is FXWLLDQGLXWUFD-OZPRGXNDSA-O. The full InChI is InChI=1S/CH4O.CH4.O2.H2O/c1-2;;1-2;/h2H,1H3;1H4;;1H2/p+1/i2D;;;.
What are the key properties of deuteriooxymethane;hydron;methane;molecular oxygen;hydrate?
deuteriooxymethane;hydron;methane;molecular oxygen;hydrate has a molecular weight of 100.11 g/mol, XLogP of -0.40, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for deuteriooxymethane;hydron;methane;molecular oxygen;hydrate is sourced from PubChem (CID 160777204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).