Basic information
- CAS
2453-29-4- Standard SMILES
S=P(c1ccccc1)(N1CC1)N1CC1- InChIKey
CMBJWQYWYDSRGT-UHFFFAOYSA-N- Molecular formula
- C10H13N2PS
- Average molar mass
- 224.26 g/mol
- Monoisotopic mass
- 224.05370659
Names & identifiers
- Preferred name
- 1,1'-(Phenylphosphorothioyl)diaziridine
- IUPAC
- bis(aziridin-1-yl)-phenyl-sulfanylidene-λ5-phosphane
Names & synonyms
2453-29-41,1'-(phenylphosphorothioyl)diaziridineENT 50318NSC54056DTXSID40281417NSC21600NSC57069NSC-21600NSC-54056NSC-570691,1'-(Phenylphosphorothioyl)bis(aziridine)Phosphine sulfide, bis(1-aziridinyl)phenyl-
Database identifiers
- CAS
2453-29-4- PubChem CID
- 228577
- DTXSID
DTXSID40281417
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 38.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 251
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…