1-Propanol, 2-methyl-2-(methylsulfinyl)-
Basic information
- CAS
25841-37-6- Standard SMILES
CS(=O)C(C)(C)CO- InChIKey
WMQJISWTXNKOBA-UHFFFAOYSA-N- Molecular formula
- C5H12O2S
- Average molar mass
- 136.21 g/mol
- Monoisotopic mass
- 136.05580079
Names & identifiers
- Preferred name
- 1-Propanol, 2-methyl-2-(methylsulfinyl)-
- IUPAC
- 2-methyl-2-methylsulfinylpropan-1-ol
Names & synonyms
25841-37-61-Propanol, 2-methyl-2-(methylsulfinyl)-RefChem:1056907Aldicarb alcohol sulfoxide2-Methyl-2-(methylsulfinyl)propanolBRN 1923609DTXSID609487322-methyl-2-(methylsulfinyl)propanol-12-(Methanesulfinyl)-2-methylpropan-1-ol
Database identifiers
- CAS
25841-37-6- PubChem CID
- 213237
- DTXSID
DTXSID60948732
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 56.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 98.6
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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