2-methoxyethanolate

C3H7O2- — CID 5162451

IUPAC2-methoxyethanolate
SMILESCOCC[O-]
InChIInChI=1S/C3H7O2/c1-5-3-2-4/h2-3H2,1H3/q-1
InChIKeyASQUQUOEFDHYGP-UHFFFAOYSA-N
MW75.09 g/mol
LogP-1.01
Rot. Bonds2

About 2-methoxyethanolate

2-methoxyethanolate (PubChem CID 5162451) has the molecular formula C3H7O2- and a molecular weight of 75.09 g/mol. Its IUPAC name is 2-methoxyethanolate.

Molecular Properties

Compound Name2-methoxyethanolate
PubChem CID5162451
Molecular FormulaC3H7O2-
Molecular Weight75.09 g/mol
Exact Mass75.05
IUPAC Name2-methoxyethanolate
SMILESCOCC[O-]
InChIInChI=1S/C3H7O2/c1-5-3-2-4/h2-3H2,1H3/q-1
InChIKeyASQUQUOEFDHYGP-UHFFFAOYSA-N
XLogP-1.01
TPSA32.29 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50075.09
LogP ≤ 5-1.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methoxyethanolate?
The IUPAC name of 2-methoxyethanolate (CID 5162451) is 2-methoxyethanolate.
What is the SMILES notation for 2-methoxyethanolate?
The canonical SMILES for 2-methoxyethanolate is COCC[O-].
What is the InChIKey of 2-methoxyethanolate?
The InChIKey is ASQUQUOEFDHYGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7O2/c1-5-3-2-4/h2-3H2,1H3/q-1.
What are the key properties of 2-methoxyethanolate?
2-methoxyethanolate has a molecular weight of 75.09 g/mol, XLogP of -1.01, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxyethanolate is sourced from PubChem (CID 5162451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).