Ammonium, (phosphinicobis(iminotrimethylene))bis(benzyldiethyl-, dibromide, p-tolyl ester

HCID 29472

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Basic information

CAS: 19143-07-8
Standard SMILES: CC[N+](CC)(CCCNP(=O)(NCCC[N+](CC)(CC)Cc1ccccc1)Oc1ccc(C)cc1)Cc1ccccc1.[Br-].[Br-]
InChIKey: NXFXZURIDSYOPT-UHFFFAOYSA-L
Molecular formula: C35H55Br2N4O2P
Average molar mass: 754.6 g/mol
Monoisotopic mass: 752.24294

Names & identifiers

Preferred name: Ammonium, (phosphinicobis(iminotrimethylene))bis(benzyldiethyl-, dibromide, p-tolyl ester
IUPAC: benzyl-[3-[[[3-[benzyl(diethyl)azaniumyl]propylamino]-(4-methylphenoxy)phosphoryl]amino]propyl]-diethylazanium dibromide

Names & synonyms

H.C. 9012(Phosphinicobis(iminotrimethylene))bis(benzyldiethylammonium bromide) p-tolyl ester19143-07-8Ammonium, (phosphinicobis(iminotrimethylene))bis(benzyldiethyl-, dibromide, p-tolyl esterRefChem:319112DTXSID609407713,3'-{[(4-Methylphenoxy)phosphoryl]bis(azanediyl)}bis(N-benzyl-N,N-diethylpropan-1-aminium) dibromide3,3'-{[(4-Methylphenoxy)phosphoryl]diazanediyl}bis(N-benzyl-N,N-diethylpropan-1-aminium) dibromide

Database identifiers

CAS: 19143-07-8
PubChem CID: 29472
DTXSID: DTXSID60940771

Properties

Computed structural properties

Topological polar surface area: 50.4 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 6
Rotatable bonds: 20
Heavy atoms: 44
Formal charge: 0
Complexity: 704

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