Aniline, 4,4'-(heptamethylenedioxy)bis(N,N-dimethyl-, hydrochloride

HCID 60688

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 119041-07-5
Standard SMILES: CN(C)c1ccc(OCCCCCCCOc2ccc([NH+](C)C)cc2)cc1.[Cl-]
InChIKey: JRUJDZUAYIUKBF-UHFFFAOYSA-N
Molecular formula: C23H35ClN2O2
Average molar mass: 407 g/mol
Monoisotopic mass: 406.2387061

Names & identifiers

Preferred name: Aniline, 4,4'-(heptamethylenedioxy)bis(N,N-dimethyl-, hydrochloride
IUPAC: [4-[7-[4-(dimethylamino)phenoxy]heptoxy]phenyl]-dimethylazanium chloride

Names & synonyms

4,4'-(Heptamethylenedioxy)bis(N,N-dimethylaniline) hydrochloride119041-07-5ANILINE, 4,4'-(HEPTAMETHYLENEDIOXY)BIS(N,N-DIMETHYL-, HYDROCHLORIDERefChem:319598

Database identifiers

CAS: 119041-07-5
PubChem CID: 60688

Properties

Computed structural properties

Topological polar surface area: 26.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 12
Heavy atoms: 28
Formal charge: 0
Complexity: 359

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…