DICETYLDIMONIUM ACETATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C34H72N.C2H3O2
Molecular Weight	553.9862
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC([O-])=O.CCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCC

InChI

InChIKey=XJAKUIIGQJMOHE-UHFFFAOYSA-M

InChI=1S/C34H72N.C2H4O2/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35(3,4)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2;1-2(3)4/h5-34H2,1-4H3;1H3,(H,3,4)/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula	C34H72N
Molecular Weight	494.9422
Charge	1
Count

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

Molecular Formula	C2H3O2
Molecular Weight	59.044
Charge	-1
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:31:39 UTC 2023` Edited by `admin` on `Sat Dec 16 10:31:39 UTC 2023`
Record UNII	600C05ZVQ7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DICETYLDIMONIUM ACETATE

Common Name

English

1-HEXADECANAMINIUM, N-HEXADECYL-N,N-DIMETHYL-, ACETATE (1:1)

Systematic Name

English

DIHEXADECYLDIMETHYLAMMONIUM ACETATE

Systematic Name

English

Code System Code Type Description

FDA UNII

600C05ZVQ7

Created by admin on Sat Dec 16 10:31:39 UTC 2023 , Edited by admin on Sat Dec 16 10:31:39 UTC 2023

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PUBCHEM

11238237

Created by admin on Sat Dec 16 10:31:39 UTC 2023 , Edited by admin on Sat Dec 16 10:31:39 UTC 2023

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EPA CompTox

DTXSID10459681

Created by admin on Sat Dec 16 10:31:39 UTC 2023 , Edited by admin on Sat Dec 16 10:31:39 UTC 2023

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CAS

71326-37-9

Created by admin on Sat Dec 16 10:31:39 UTC 2023 , Edited by admin on Sat Dec 16 10:31:39 UTC 2023

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