Ammonium, (p-phenylene)dimethylenebis(1-methyl-3-(2,2,6-trimethylcyclohexyl)propyl)bis(dimethyl-, dibromide

HCID 48050

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Basic information

CAS: 66827-15-4
Standard SMILES: CC1CCCC(C)(C)C1CCC(C)[N+](C)(C)Cc1ccc(C[N+](C)(C)C(C)CCC2C(C)CCCC2(C)C)cc1.[Br-].[Br-]
InChIKey: MDJKEFNACOFQHB-UHFFFAOYSA-L
Molecular formula: C38H70Br2N2
Average molar mass: 714.8 g/mol
Monoisotopic mass: 712.39058

Names & identifiers

Preferred name: Ammonium, (p-phenylene)dimethylenebis(1-methyl-3-(2,2,6-trimethylcyclohexyl)propyl)bis(dimethyl-, dibromide
IUPAC: [4-[[dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azaniumyl]methyl]phenyl]methyl-dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azanium dibromide

Names & synonyms

66827-15-4Ammonium, (p-phenylene)dimethylenebis(1-methyl-3-(2,2,6-trimethylcyclohexyl)propyl)bis(dimethyl-, dibromideRefChem:319084DTXSID80985386N,N'-[1,4-Phenylenebis(methylene)]bis[N,N-dimethyl-4-(2,2,6-trimethylcyclohexyl)butan-2-aminium] dibromide

Database identifiers

CAS: 66827-15-4
PubChem CID: 48050
DTXSID: DTXSID80985386

Properties

Computed structural properties

Topological polar surface area: 0 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 12
Heavy atoms: 42
Formal charge: 0
Complexity: 691

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