Dodecan-1,12-diylbis(benzyldimethylammonium) dichloride

Details

Stereochemistry	ACHIRAL
Molecular Formula	C30H50N2.2Cl
Molecular Weight	509.637
Optical Activity	NONE
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Dodecan-1,12-diylbis(benzyldimethylammonium) dichloride

Structure Search

SMILES

[Cl-].[Cl-].C[N+](C)(CCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1)CC2=CC=CC=C2

InChI

InChIKey=YPBOGOKUBITHPK-UHFFFAOYSA-L

InChI=1S/C30H50N2.2ClH/c1-31(2,27-29-21-15-13-16-22-29)25-19-11-9-7-5-6-8-10-12-20-26-32(3,4)28-30-23-17-14-18-24-30;;/h13-18,21-24H,5-12,19-20,25-28H2,1-4H3;2*1H/q+2;;/p-2

HIDE SMILES / InChI

Molecular Formula	Cl
Molecular Weight	35.453
Charge	-1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C30H50N2
Molecular Weight	438.7314
Charge	2
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 2
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 18:52:50 GMT 2025` Edited by `admin` on `Tue Apr 01 18:52:50 GMT 2025`
Record UNII	U7PN65J5W8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Dodecan-1,12-diylbis(benzyldimethylammonium) dichloride

Systematic Name

English

1,12-Dodecanediaminium, N1,N1,N12,N12-tetramethyl-N1,N12-bis(phenylmethyl)-, chloride (1:2)

Preferred Name

English

Code System Code Type Description

ECHA (EC/EINECS)

303-840-9