methanol;methanolate

C2H7O2- — CID 131719842

IUPACmethanol;methanolate
SMILESCO.C[O-]
InChIInChI=1S/CH4O.CH3O/c2*1-2/h2H,1H3;1H3/q;-1
InChIKeyNPRPHDSQZBFINE-UHFFFAOYSA-N
MW63.08 g/mol
LogP-1.41
Rot. Bonds

About methanol;methanolate

methanol;methanolate (PubChem CID 131719842) has the molecular formula C2H7O2- and a molecular weight of 63.08 g/mol. Its IUPAC name is methanol;methanolate.

Molecular Properties

Compound Namemethanol;methanolate
PubChem CID131719842
Molecular FormulaC2H7O2-
Molecular Weight63.08 g/mol
Exact Mass63.05
IUPAC Namemethanol;methanolate
SMILESCO.C[O-]
InChIInChI=1S/CH4O.CH3O/c2*1-2/h2H,1H3;1H3/q;-1
InChIKeyNPRPHDSQZBFINE-UHFFFAOYSA-N
XLogP-1.41
TPSA43.29 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50063.08
LogP ≤ 5-1.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 18724721

Frequently Asked Questions

What is the IUPAC name of methanol;methanolate?
The IUPAC name of methanol;methanolate (CID 131719842) is methanol;methanolate.
What is the SMILES notation for methanol;methanolate?
The canonical SMILES for methanol;methanolate is CO.C[O-].
What is the InChIKey of methanol;methanolate?
The InChIKey is NPRPHDSQZBFINE-UHFFFAOYSA-N. The full InChI is InChI=1S/CH4O.CH3O/c2*1-2/h2H,1H3;1H3/q;-1.
What are the key properties of methanol;methanolate?
methanol;methanolate has a molecular weight of 63.08 g/mol, XLogP of -1.41, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;methanolate is sourced from PubChem (CID 131719842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).