2-METHYLDODECYLXYLELENE BIS(TRIMETHYLAMMONIUM)

Details

Stereochemistry	ACHIRAL
Molecular Formula	C27H52N2
Molecular Weight	404.7152
Optical Activity	NONE
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	2

SHOW SMILES / InChI

Structure of 2-METHYLDODECYLXYLELENE BIS(TRIMETHYLAMMONIUM)

Structure Search

SMILES

CCCCCCCCCCCCC1=CC(C[N+](C)(C)C)=C(C)C(C[N+](C)(C)C)=C1

InChI

InChIKey=WLKJGBPEKSXRKB-UHFFFAOYSA-N

InChI=1S/C27H52N2/c1-9-10-11-12-13-14-15-16-17-18-19-25-20-26(22-28(3,4)5)24(2)27(21-25)23-29(6,7)8/h20-21H,9-19,22-23H2,1-8H3/q+2

HIDE SMILES / InChI

Approval Year

Name

Type

Language

((5-DODECYL-2-METHYL-M-PHENYLENE)DIMETHYLENE)BIS(TRIMETHYLAMMONIUM)

Preferred Name

English

2-METHYLDODECYLXYLELENE BIS(TRIMETHYLAMMONIUM)

Common Name

English

1,3-BENZENEDIMETHANAMINIUM, 5-DODECYL-N,N,N,N',N',N',2-HEPTAMETHYL-

Systematic Name

English

1,3-BENZENEDIMETHANAMINIUM, 5-DODECYL-N1,N1,N1,N3,N3,N3,2-HEPTAMETHYL-

Systematic Name

English

(DODECYLMETHYLXYLYLENE)BIS(TRIMETHYLAMMONIUM)

Systematic Name

English

Code System Code Type Description

FDA UNII

63KHY2YCJ3

Created by admin on Mon Mar 31 23:00:20 GMT 2025 , Edited by admin on Mon Mar 31 23:00:20 GMT 2025

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PUBCHEM

118796497

Created by admin on Mon Mar 31 23:00:20 GMT 2025 , Edited by admin on Mon Mar 31 23:00:20 GMT 2025

PRIMARY

EPA CompTox

DTXSID80872944

Created by admin on Mon Mar 31 23:00:20 GMT 2025 , Edited by admin on Mon Mar 31 23:00:20 GMT 2025

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CAS

767586-00-5

Created by admin on Mon Mar 31 23:00:20 GMT 2025 , Edited by admin on Mon Mar 31 23:00:20 GMT 2025

PRIMARY

ACTIVE MOIETY


					63KHY2YCJ3

2-METHYLDODECYLXYLELENE BIS(TRIMETHYLAMMONIUM)

SALT/SOLVATE (PARENT)


					GZ50BZ0172

2-METHYLDODECYLXYLELENE BIS(TRIMETHYLAMMONIUM CHLORIDE)