disodium;methanone

CHNa2O+ — CID 21138399

IUPACdisodium;methanone
SMILES[CH-]=O.[Na+].[Na+]
InChIInChI=1S/CHO.2Na/c1-2;;/h1H;;/q-1;2*+1
InChIKeyFPTNSMJGACKGKP-UHFFFAOYSA-N
MW75.00 g/mol
LogP-6.27
Rot. Bonds

About disodium;methanone

disodium;methanone (PubChem CID 21138399) has the molecular formula CHNa2O+ and a molecular weight of 75.00 g/mol. Its IUPAC name is disodium;methanone.

Molecular Properties

Compound Namedisodium;methanone
PubChem CID21138399
Molecular FormulaCHNa2O+
Molecular Weight75.00 g/mol
Exact Mass74.98
IUPAC Namedisodium;methanone
SMILES[CH-]=O.[Na+].[Na+]
InChIInChI=1S/CHO.2Na/c1-2;;/h1H;;/q-1;2*+1
InChIKeyFPTNSMJGACKGKP-UHFFFAOYSA-N
XLogP-6.27
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50075.00
LogP ≤ 5-6.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze disodium;methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

sodium;carbanide;methanone
CID 58059383
methane;methanone
CID 159005271
methanone;technetium
CID 87143349
methanone;vanadium(2+)
CID 22892185
methanone;rhodium(2+)
CID 20723931
dicesium;methanone
CID 59087112
methanone;nickel(2+)
CID 22982994
methanone;protactinium
CID 23382582
methanone;rhodium
CID 87421568
manganese;methanone
CID 57468561
sodium;methanone;sulfanediol
CID 87276429
carbanide;iron(5+);methanone
CID 171048429

Frequently Asked Questions

What is the IUPAC name of disodium;methanone?
The IUPAC name of disodium;methanone (CID 21138399) is disodium;methanone.
What is the SMILES notation for disodium;methanone?
The canonical SMILES for disodium;methanone is [CH-]=O.[Na+].[Na+].
What is the InChIKey of disodium;methanone?
The InChIKey is FPTNSMJGACKGKP-UHFFFAOYSA-N. The full InChI is InChI=1S/CHO.2Na/c1-2;;/h1H;;/q-1;2*+1.
What are the key properties of disodium;methanone?
disodium;methanone has a molecular weight of 75.00 g/mol, XLogP of -6.27, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for disodium;methanone is sourced from PubChem (CID 21138399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).