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Basic information
- CAS
690-78-8- Standard SMILES
O=C(CS(=O)(=O)O)CS(=O)(=O)O- InChIKey
BFSIDIWZBQSIHF-UHFFFAOYSA-N- Molecular formula
- C3H6O7S2
- Average molar mass
- 218.2 g/mol
- Monoisotopic mass
- 217.95549487
Names & identifiers
- Preferred name
- 2-Oxopropane-1,3-disulphonic acid
- IUPAC
- 2-oxopropane-1,3-disulfonic acid
- English name
- 2-oxopropane-1,3-disulphonic acid
- Molecular formula
- C3H6O7S2
- Molecular weight
- 218.20554
Names & synonyms
2-oxopropane-1,3-disulfonic acid2-Oxopropane-1,3-disulphonic acid690-78-85B38KF5WZQ2-oxo-1,3-propanedisulfonic acidEINECS 211-718-01,3-Propanedisulfonic acid, 2-oxo-UNII-5B38KF5WZQSCHEMBL4968468DTXSID70219041BFSIDIWZBQSIHF-UHFFFAOYSA-N2-OXO-1,3-PROPANEDISULPHONIC ACID
Show more names
Acetonedisulfonic acidAcetone disulfonic acid
NS000367991,3-PROPANEDISULPHONIC ACID, 2-OXO-
Database identifiers
- CAS
690-78-8- PubChem CID
- 69648
- DTXSID
DTXSID70219041- UNII
- 5B38KF5WZQ
- EC Number
- 211-718-0
- Nikkaji
- J57.762F
Properties
Computed structural propertiesFilling in
- XLogP
- -2.2
- Topological polar surface area
- 143 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 312
Physicochemical properties
- FDA UNII
- 5 B38KF5WZQ · 5B38KF5WZQ
Chemistry & industry
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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