Ethanedisulfonic acid

C₂H₆O₆S₂CAS 110-04-3190.18 g/mol

Open in Covalent MOL file

Sulfonic acid

Properties

Molecular formula: C₂H₆O₆S₂
Molar mass: 190.18 g/mol
Exact mass: 189.9606 Da
Melting point: 173 °C
logP: -1.24Crippen estimate
Polar surface area: 108.7 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 3

Hazards

Danger

H290 May be corrosive to metals22.2% of notifiers
H314 Causes severe skin burns and eye damage100% of notifiers
H318 Causes serious eye damage33.3% of notifiers
H319 Causes serious eye irritation11.1% of notifiers

Aggregated from 9 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P234, P260, P264, P264+P265, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P321, P337+P317, P363, P390, P405, P406, P501

Identifiers

CAS number

110-04-3

SMILES

O=S(=O)(O)CCS(=O)(=O)O

InChIKey

AFAXGSQYZLGZPG-UHFFFAOYSA-N

InChI

InChI=1S/C2H6O6S2/c3-9(4,5)1-2-10(6,7)8/h1-2H2,(H,3,4,5)(H,6,7,8)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

5 names

1,2-Ethanedisulfonic acid
Allergosil
Ethane-α,β-disulfonic acid
Ethylenedisulfonic acid
1,2-Ethylenedisulfonic acid

Work with Ethanedisulfonic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Disodium 1,2-ethanedisulfonate5325-43-9Salt

Similar compounds

1,3-Propanedisulfonic acid21668-77-973 % similar 1,4-Butanedisulfonic acid27665-39-073 % similar Isethionic acid107-36-865 % similar Taurine107-35-761 % similar Bromoethanesulfonic acid26978-65-461 % similar Coenzyme M3375-50-661 % similar 1-Propanesulfonic acid5284-66-261 % similar Methanedisulfonic acid503-40-260 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia