Basic information
- CAS
125643-59-6- Standard SMILES
CC(C)COP(=S)(S)OC(C)C- InChIKey
IYQRQKHKWJUYEM-UHFFFAOYSA-N- Molecular formula
- C7H17O2PS2
- Average molar mass
- 228.3 g/mol
- Monoisotopic mass
- 228.04075913
Names & identifiers
- Preferred name
- O-(2-Methylpropyl) O-propan-2-yl hydrogen phosphorodithioate
- IUPAC
- 2-methylpropoxy-propan-2-yloxy-sulfanyl-sulfanylidene-λ5-phosphane
Names & synonyms
DTXSID50925198O-(2-Methylpropyl) O-(propan-2-yl) hydrogen phosphorodithioateO-(2-Methylpropyl) O-propan-2-yl hydrogen phosphorodithioate769878-53-7
Database identifiers
- CAS
125643-59-6、769878-53-7- PubChem CID
- 86377
- DTXSID
DTXSID50925198
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 51.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 171
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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