Basic information
- CAS
78051-43-1- Standard SMILES
CN(SN(C(C)(C)C)P1(=S)OCC(C)(C)CO1)C(=O)F- InChIKey
GJDZUNHDLFARBO-UHFFFAOYSA-N- Molecular formula
- C11H22FN2O3PS2
- Average molar mass
- 344.4 g/mol
- Monoisotopic mass
- 344.07935007
Names & identifiers
- Preferred name
- Agn-PC-0jkzy2
- IUPAC
- N-[tert-butyl-(5,5-dimethyl-2-sulfanylidene-1,3,2λ5-dioxaphosphinan-2-yl)amino]sulfanyl-N-methylcarbamoyl fluoride
Names & synonyms
AGN-PC-0JKZY278051-43-1SCHEMBL11424987DTXSID00275599{[tert-Butyl(5,5-dimethyl-2-sulfanylidene-1,3,2lambda~5~-dioxaphosphinan-2-yl)amino]sulfanyl}(methyl)carbamoyl fluoride
Database identifiers
- CAS
78051-43-1- PubChem CID
- 54048
- DTXSID
DTXSID00275599- Nikkaji
- J1.591.167K
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 99.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 414
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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