Benzenemethanaminium, N,N-diethyl-N-[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethyl]-, chloride (1:1)

CAS Registry Number®

78-05-7

CAS Name

Benzenemethanaminium, N,N-diethyl-N-[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethyl]-, chloride (1:1)

Molecular Formula

C27H42NO.Cl

Cite this Page

Benzenemethanaminium, N,N-diethyl-N-[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethyl]-, chloride (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=78-05-7 (retrieved 2024-11-23) (CAS RN: 78-05-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    113 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C27H42NO.ClH/c1-8-28(9-2,21-23-13-11-10-12-14-23)19-20-29-25-17-15-24(16-18-25)27(6,7)22-26(3,4)5;/h10-18H,8-9,19-22H2,1-7H3;1H/q+1;/p-1

InChIKey

InChIKey=DPECLNSLLIQJJO-UHFFFAOYSA-M

SMILES

[N+](CC1=CC=CC=C1)(CCOC2=CC=C(C(CC(C)(C)C)(C)C)C=C2)(CC)CC.[Cl-]

Canonical SMILES

[Cl-].O(C1=CC=C(C=C1)C(C)(C)CC(C)(C)C)CC[N+](CC=2C=CC=CC2)(CC)CC

Other Names for this Substance

  • Benzenemethanaminium, N,N-diethyl-N-[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethyl]-, chloride (1:1)
  • Ammonium, benzyldiethyl[2-[p-(1,1,3,3-tetramethylbutyl)phenoxy]ethyl]-, chloride
  • Benzyldiethyl-2-[p-(1,1,3,3-tetramethylbutyl)phenoxy]ethylammonium chloride
  • Benzenemethanaminium, N,N-diethyl-N-[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]ethyl]-, chloride
  • Octaphen

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