dilithium;oxomethanolate;hydroxide

CHLi2O3- — CID 153463878

IUPACdilithium;oxomethanolate;hydroxide
SMILESO=[C-][O-].[Li+].[Li+].[OH-]
InChIInChI=1S/CO2.2Li.H2O/c2-1-3;;;/h;;;1H2/q-2;2*+1;/p-1
InChIKeyBJRRQYURNUOHFZ-UHFFFAOYSA-M
MW74.90 g/mol
LogP-7.89
Rot. Bonds

About dilithium;oxomethanolate;hydroxide

dilithium;oxomethanolate;hydroxide (PubChem CID 153463878) has the molecular formula CHLi2O3- and a molecular weight of 74.90 g/mol. Its IUPAC name is dilithium;oxomethanolate;hydroxide.

Molecular Properties

Compound Namedilithium;oxomethanolate;hydroxide
PubChem CID153463878
Molecular FormulaCHLi2O3-
Molecular Weight74.90 g/mol
Exact Mass75.03
IUPAC Namedilithium;oxomethanolate;hydroxide
SMILESO=[C-][O-].[Li+].[Li+].[OH-]
InChIInChI=1S/CO2.2Li.H2O/c2-1-3;;;/h;;;1H2/q-2;2*+1;/p-1
InChIKeyBJRRQYURNUOHFZ-UHFFFAOYSA-M
XLogP-7.89
TPSA70.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50074.90
LogP ≤ 5-7.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of dilithium;oxomethanolate;hydroxide?
The IUPAC name of dilithium;oxomethanolate;hydroxide (CID 153463878) is dilithium;oxomethanolate;hydroxide.
What is the SMILES notation for dilithium;oxomethanolate;hydroxide?
The canonical SMILES for dilithium;oxomethanolate;hydroxide is O=[C-][O-].[Li+].[Li+].[OH-].
What is the InChIKey of dilithium;oxomethanolate;hydroxide?
The InChIKey is BJRRQYURNUOHFZ-UHFFFAOYSA-M. The full InChI is InChI=1S/CO2.2Li.H2O/c2-1-3;;;/h;;;1H2/q-2;2*+1;/p-1.
What are the key properties of dilithium;oxomethanolate;hydroxide?
dilithium;oxomethanolate;hydroxide has a molecular weight of 74.90 g/mol, XLogP of -7.89, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dilithium;oxomethanolate;hydroxide is sourced from PubChem (CID 153463878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).