2,4,6-Tris(dihydroxyphosphinothioyloxy)cyclohexane-1,3,5-triol
Basic information
- CAS
155666-60-7- Standard SMILES
OC1C(OP(O)(O)=S)C(O)C(OP(O)(O)=S)C(O)C1OP(O)(O)=S- InChIKey
BNPWKCQRQYTUQE-UHFFFAOYSA-N- Molecular formula
- C6H15O12P3S3
- Average molar mass
- 468.3 g/mol
- Monoisotopic mass
- 467.89385042
Names & identifiers
- Preferred name
- 2,4,6-Tris(dihydroxyphosphinothioyloxy)cyclohexane-1,3,5-triol
- IUPAC
- 2,4,6-tris(dihydroxyphosphinothioyloxy)cyclohexane-1,3,5-triol
Names & synonyms
CHEMBL1161536
Database identifiers
- CAS
155666-60-7- PubChem CID
- 11754367
- ChEMBL
CHEMBL1161536
Properties
Computed structural properties
- XLogP
- -1.8
- Topological polar surface area
- 306 Ų
- Hydrogen bond donors
- 9
- Hydrogen bond acceptors
- 15
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 486
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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