1,2,3-Propanetriol, mixt. with sulfinylbis(methane)
Basic information
- CAS
79682-30-7- Standard SMILES
CS(C)=O.OCC(O)CO- InChIKey
RQIPBIVCBNQPDN-UHFFFAOYSA-N- Molecular formula
- C5H14O4S
- Average molar mass
- 170.23 g/mol
- Monoisotopic mass
- 170.0612801
Names & identifiers
- Preferred name
- 1,2,3-Propanetriol, mixt. with sulfinylbis(methane)
- IUPAC
- methylsulfinylmethane;propane-1,2,3-triol
- English name
- KM 26
- Molecular formula
- C5H14O4S
- Molecular weight
- 170.22726
Names & synonyms
1,2,3-Propanetriol, mixt. with sulfinylbis(methane)79682-30-7Cryoprotective agent KM 26methylsulfinylmethane;propane-1,2,3-triolSCHEMBL998993DTXSID101000662KM 26KM-26Propane-1,2,3-triol--(methanesulfinyl)methane (1/1)
Database identifiers
- CAS
79682-30-7- PubChem CID
- 133256
- DTXSID
DTXSID101000662
Properties
Computed structural properties
- Topological polar surface area
- 97 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 54.2
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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