methoxy(oxidooxy)methane

C2H5O3- — CID 102170824

IUPACmethoxy(oxidooxy)methane
SMILESCOCO[O-]
InChIInChI=1S/C2H6O3/c1-4-2-5-3/h3H,2H2,1H3/p-1
InChIKeyCDXAGPPPWKCPRI-UHFFFAOYSA-M
MW77.06 g/mol
LogP-1.12
Rot. Bonds2

About methoxy(oxidooxy)methane

methoxy(oxidooxy)methane (PubChem CID 102170824) has the molecular formula C2H5O3- and a molecular weight of 77.06 g/mol. Its IUPAC name is methoxy(oxidooxy)methane.

Molecular Properties

Compound Namemethoxy(oxidooxy)methane
PubChem CID102170824
Molecular FormulaC2H5O3-
Molecular Weight77.06 g/mol
Exact Mass77.02
IUPAC Namemethoxy(oxidooxy)methane
SMILESCOCO[O-]
InChIInChI=1S/C2H6O3/c1-4-2-5-3/h3H,2H2,1H3/p-1
InChIKeyCDXAGPPPWKCPRI-UHFFFAOYSA-M
XLogP-1.12
TPSA41.52 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50077.06
LogP ≤ 5-1.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Related Compounds

oxidooxy(oxidooxymethylperoxy)methane;bis(platinum(4+))
CID 173435002
2,2-bis(hydroxymethyl)propane-1,3-diol;dimethoxymethane
CID 158716862
(2R,3R)-2,3-bis(methoxymethoxy)butane-1,4-diol
CID 11063695
carbanylium;1-(methoxymethoxy)-3-oxidooxypropane-2-sulfonate
CID 161459706
sodium methoxymethanolate
CID 23708081
barium(2+);oxidooxymethane
CID 101085331
(2R)-2-(methoxymethoxy)propan-1-ol
CID 10975472
sodium methoxymethyl carbonate
CID 139846012
[4-(methoxymethoxy)phenyl]methanol
CID 11607984
bis(dimethoxymethane);ethoxymethoxyethane
CID 158499247
CID 101086860
CID 101086860
cyanamide;dimethoxymethane
CID 174354277

Frequently Asked Questions

What is the IUPAC name of methoxy(oxidooxy)methane?
The IUPAC name of methoxy(oxidooxy)methane (CID 102170824) is methoxy(oxidooxy)methane.
What is the SMILES notation for methoxy(oxidooxy)methane?
The canonical SMILES for methoxy(oxidooxy)methane is COCO[O-].
What is the InChIKey of methoxy(oxidooxy)methane?
The InChIKey is CDXAGPPPWKCPRI-UHFFFAOYSA-M. The full InChI is InChI=1S/C2H6O3/c1-4-2-5-3/h3H,2H2,1H3/p-1.
What are the key properties of methoxy(oxidooxy)methane?
methoxy(oxidooxy)methane has a molecular weight of 77.06 g/mol, XLogP of -1.12, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy(oxidooxy)methane is sourced from PubChem (CID 102170824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).