Stearalkonium bentonite

Details

Stereochemistry	ACHIRAL
Molecular Formula	C27H50N.2Al.Cl.3O.4O2Si.H2O
Molecular Weight	784.459
Optical Activity	NONE
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O.[O--].[O--].[O--].[Al+3].[Al+3].[Cl-].O=[Si]=O.O=[Si]=O.O=[Si]=O.O=[Si]=O.CCCCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1

InChI

InChIKey=DFJIDAUICIBKBP-UHFFFAOYSA-M

InChI=1S/C27H50N.2Al.ClH.4O2Si.H2O.3O/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-28(2,3)26-27-23-20-19-21-24-27;;;;4*1-3-2;;;;/h19-21,23-24H,4-18,22,25-26H2,1-3H3;;;1H;;;;;1H2;;;/q+1;2*+3;;;;;;;3*-2/p-1

HIDE SMILES / InChI

Molecular Formula	HO
Molecular Weight	17.0073
Charge	-1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	O2Si
Molecular Weight	60.0843
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C27H50N
Molecular Weight	388.6926
Charge	1
Count

Stereochemistry	RACEMIC
Additional Stereochemistry
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Molecular Formula	Al
Molecular Weight	26.9815386
Charge	3
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 20:31:38 GMT 2025` Edited by `admin` on `Wed Apr 02 20:31:38 GMT 2025`
Record UNII	AH5EVE6GTY
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TIXOGEL VZ-V

Preferred Name

English

Stearalkonium bentonite

Common Name

English

Code System Code Type Description

FDA UNII

AH5EVE6GTY

Created by admin on Wed Apr 02 20:31:38 GMT 2025 , Edited by admin on Wed Apr 02 20:31:38 GMT 2025

PRIMARY

CAS

130501-87-0

Created by admin on Wed Apr 02 20:31:38 GMT 2025 , Edited by admin on Wed Apr 02 20:31:38 GMT 2025

GENERIC (FAMILY)

CAS

180473-10-3

Created by admin on Wed Apr 02 20:31:38 GMT 2025 , Edited by admin on Wed Apr 02 20:31:38 GMT 2025

SUPERSEDED

CAS

865314-53-0

Created by admin on Wed Apr 02 20:31:38 GMT 2025 , Edited by admin on Wed Apr 02 20:31:38 GMT 2025

SUPERSEDED

Name	Property Type	Amount	Referenced Substance	Defining	Parameters	References
PARTICLE SIZE	PHYSICAL