Basic information
- CAS
18671-82-4- Standard SMILES
C[N+](C)(CCCCCCCCCC[N+](C)(C)CCNP(=O)(Oc1ccccc1)Oc1ccccc1)CCNP(=O)(Oc1ccccc1)Oc1ccccc1.[Br-].[Br-]- InChIKey
ZAZIKRFJABTECY-UHFFFAOYSA-L- Molecular formula
- C42H62Br2N4O6P2
- Average molar mass
- 940.7 g/mol
- Monoisotopic mass
- 938.25113
Names & identifiers
- Preferred name
- HC 9016
- IUPAC
- 2-(diphenoxyphosphorylamino)ethyl-[10-[2-(diphenoxyphosphorylamino)ethyl-dimethylazaniumyl]decyl]-dimethylazanium dibromide
Names & synonyms
18671-82-4HC 90169016 HCDecamethylenebis(dimethyl(2-(diphenylphosphonoamino)ethyl)ammonium bromide)Ammonium, decamethylenebis(dimethyl(2-(phosphonoamino)ethyl)-, dibromide, tetraphenyl esterRefChem:3470842-(diphenoxyphosphorylamino)ethyl-[10-[2-(diphenoxyphosphorylamino)ethyl-dimethylazaniumyl]decyl]-dimethylazanium;dibromideorb1697016DTXSID40940138AKOS040751998T32048N~1~,N~10~-Bis{2-[(diphenoxyphosphoryl)amino]ethyl}-N~1~,N~1~,N~10~,N~10~-tetramethyldecane-1,10-bis(aminium) dibromide
Database identifiers
- CAS
18671-82-4- PubChem CID
- 29199
- DTXSID
DTXSID40940138
Properties
Computed structural properties
- Topological polar surface area
- 95.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 27
- Heavy atoms
- 56
- Formal charge
- 0
- Complexity
- 957
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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