Ammonium, (phosphinicobis(iminotrimethylene))bis(benzyldimethyl-, dibromide, phenyl ester

HCID 29470

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Basic information

CAS: 19143-06-7
Standard SMILES: C[N+](C)(CCCNP(=O)(NCCC[N+](C)(C)Cc1ccccc1)Oc1ccccc1)Cc1ccccc1.[Br-].[Br-]
InChIKey: SZCDHOCLSALTNC-UHFFFAOYSA-L
Molecular formula: C30H45Br2N4O2P
Average molar mass: 684.5 g/mol
Monoisotopic mass: 682.16469

Names & identifiers

Preferred name: Ammonium, (phosphinicobis(iminotrimethylene))bis(benzyldimethyl-, dibromide, phenyl ester
IUPAC: benzyl-[3-[[[3-[benzyl(dimethyl)azaniumyl]propylamino]-phenoxyphosphoryl]amino]propyl]-dimethylazanium dibromide

Names & synonyms

H.C. 9006(Phosphinicobis(iminotrimethylene))bis(benzyldimethylammonium bromide) phenyl ester19143-06-7Ammonium, (phosphinicobis(iminotrimethylene))bis(benzyldimethyl-, dibromide, phenyl esterRefChem:319116DTXSID009407703,3'-[(Phenoxyphosphoryl)diazanediyl]bis(N-benzyl-N,N-dimethylpropan-1-aminium) dibromide3,3'-[(Phenoxyphosphoryl)bis(azanediyl)]bis(N-benzyl-N,N-dimethylpropan-1-aminium) dibromide

Database identifiers

CAS: 19143-06-7
PubChem CID: 29470
DTXSID: DTXSID00940770

Properties

Computed structural properties

Topological polar surface area: 50.4 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 6
Rotatable bonds: 16
Heavy atoms: 39
Formal charge: 0
Complexity: 624

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