disodium;methane;sulfite

CH4Na2O3S — CID 86619477

IUPACdisodium;methane;sulfite
SMILESC.O=S([O-])[O-].[Na+].[Na+]
InChIInChI=1S/CH4.2Na.H2O3S/c;;;1-4(2)3/h1H4;;;(H2,1,2,3)/q;2*+1;/p-2
InChIKeyGHHVCJKIKXZLCO-UHFFFAOYSA-L
MW142.09 g/mol
LogP-6.36
Rot. Bonds

About disodium;methane;sulfite

disodium;methane;sulfite (PubChem CID 86619477) has the molecular formula CH4Na2O3S and a molecular weight of 142.09 g/mol. Its IUPAC name is disodium;methane;sulfite.

Molecular Properties

Compound Namedisodium;methane;sulfite
PubChem CID86619477
Molecular FormulaCH4Na2O3S
Molecular Weight142.09 g/mol
Exact Mass141.97
IUPAC Namedisodium;methane;sulfite
SMILESC.O=S([O-])[O-].[Na+].[Na+]
InChIInChI=1S/CH4.2Na.H2O3S/c;;;1-4(2)3/h1H4;;;(H2,1,2,3)/q;2*+1;/p-2
InChIKeyGHHVCJKIKXZLCO-UHFFFAOYSA-L
XLogP-6.36
TPSA63.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.09
LogP ≤ 5-6.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze disodium;methane;sulfite 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

disodium;sulfite
CID 516934
disodium;sulfite;hexahydrate
CID 158498638
sodium;sulfite;hydrate
CID 19366461
chromium(2+) sulfite
CID 22462027
cobalt(2+) sulfite
CID 18760923
ruthenium(2+) sulfite
CID 22610794
dicopper disulfite
CID 170844287
bis(lutetium(3+));trisulfite
CID 159878392
disodium;cyclopropane;sulfite
CID 175924940
calcium;sulfite;dihydrate
CID 23448497
hydron;iron(2+);sulfite
CID 20545645
calcium;magnesium;disulfite
CID 22465809

Frequently Asked Questions

What is the IUPAC name of disodium;methane;sulfite?
The IUPAC name of disodium;methane;sulfite (CID 86619477) is disodium;methane;sulfite.
What is the SMILES notation for disodium;methane;sulfite?
The canonical SMILES for disodium;methane;sulfite is C.O=S([O-])[O-].[Na+].[Na+].
What is the InChIKey of disodium;methane;sulfite?
The InChIKey is GHHVCJKIKXZLCO-UHFFFAOYSA-L. The full InChI is InChI=1S/CH4.2Na.H2O3S/c;;;1-4(2)3/h1H4;;;(H2,1,2,3)/q;2*+1;/p-2.
What are the key properties of disodium;methane;sulfite?
disodium;methane;sulfite has a molecular weight of 142.09 g/mol, XLogP of -6.36, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for disodium;methane;sulfite is sourced from PubChem (CID 86619477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).