2,2'-(1,4-Phenylene)bis(N-benzyl-N,N-dimethylpropan-1-aminium) dichloride

HCID 24902

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Basic information

CAS: 10072-44-3
Standard SMILES: CC(C[N+](C)(C)Cc1ccccc1)c1ccc(C(C)C[N+](C)(C)Cc2ccccc2)cc1.[Cl-].[Cl-]
InChIKey: TZCKQUHRDZKTCH-UHFFFAOYSA-L
Molecular formula: C30H42Cl2N2
Average molar mass: 501.6 g/mol
Monoisotopic mass: 500.2725047

Names & identifiers

Preferred name: 2,2'-(1,4-Phenylene)bis(N-benzyl-N,N-dimethylpropan-1-aminium) dichloride
IUPAC: benzyl-[2-[4-[1-[benzyl(dimethyl)azaniumyl]propan-2-yl]phenyl]propyl]-dimethylazanium dichloride

Names & synonyms

10072-44-3DTXSID709057102,2'-(1,4-Phenylene)bis(N-benzyl-N,N-dimethylpropan-1-aminium) dichlorideRefChem:1058853DTXCID201334812(p-Phenylenebis(1-methylethylene))bis(benzyldimethylammonium) dichloridePhenylene-p,p'-bis(2-dimethylbenzylammoniumpropyl) dichloridep-Phenylenebis(1-methylethylene)bis(benzyldimethylammonium chloride)AMMONIUM, (p-PHENYLENEBIS(1-METHYLETHYLENE))BIS(BENZYLDIMETHYL-, DICHLORIDE

Database identifiers

CAS: 10072-44-3
PubChem CID: 24902
DTXSID: DTXSID70905710

Properties

Computed structural properties

Topological polar surface area: 0 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 10
Heavy atoms: 34
Formal charge: 0
Complexity: 471

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