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Reference substances

Reference substances

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IUPAC name:
C12-C18 alkyl trimethyl ammonium chloride

Inventory

EC number:
269-922-0
EC name:
Quaternary ammonium compounds, C12-18-alkyltrimethyl, chlorides
CAS number:
68391-03-7
Description:
This substance is identified by SDA Substance Name: C12-C18 alkyl trimethyl ammonium chloride and SDA Reporting Number: 16-045-00.
CAS number:
68391-03-7

Synonyms

Molecular and structural information

Molecular formula:
C15H34ClN
C16H36ClN
C17H38ClN
C18H40ClN
C19H42ClN
C20H44ClN
C21H46ClN
Molecular weight:
>= 263.89 - <= 348.06
SMILES notation:
CCCCCCCCCCCC[N+](C)(C)C.[Cl-]
CCCCCCCCCCCCC[N+](C)(C)C.[Cl-]
CCCCCCCCCCCCCC[N+](C)(C)C.[Cl-]
CCCCCCCCCCCCCCC[N+](C)(C)C.[Cl-]
CCCCCCCCCCCCCCCC[N+](C)(C)C.[Cl-]
CCCCCCCCCCCCCCCCC[N+](C)(C)C.[Cl-]
CCCCCCCCCCCCCCCCCC[N+](C)(C)C.[Cl-]
InChl:
InChI=1S/C15H34N.ClH/c1-5-6-7-8-9-10-11-12-13-14-15-16(2,3)4;/h5-15H2,1-4H3;1H/q+1;/p-1
InChI=1S/C16H36N.ClH/c1-5-6-7-8-9-10-11-12-13-14-15-16-17(2,3)4;/h5-16H2,1-4H3;1H/q+1;/p-1
InChI=1S/C17H38N.ClH/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18(2,3)4;/h5-17H2,1-4H3;1H/q+1;/p-1
InChI=1S/C18H40N.ClH/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(2,3)4;/h5-18H2,1-4H3;1H/q+1;/p-1
InChI=1S/C19H42N.ClH/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)4;/h5-19H2,1-4H3;1H/q+1;/p-1
InChI=1S/C20H44N.ClH/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(2,3)4;/h5-20H2,1-4H3;1H/q+1;/p-1
InChI=1S/C21H46N.ClH/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(2,3)4;/h5-21H2,1-4H3;1H/q+1;/p-1
Structural formula:
Chemical structure

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