Registration Dossier
Registration Dossier
Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.
The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.
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EC number: 939-616-8 | CAS number: 68391-03-7
Reference substances
- IUPAC name:
- Quaternary ammonium compounds, C12-C18 (even numbered) alkyltrimethyl chloride
Inventory
Synonyms
- Names:
- Identifier:
- other: Molecular formula
- Not applicable, substance is a UVCB.
- Identifier:
- other: SMILES notation
- Not applicable, substance is a UVCB.
- Identifier:
- other: InChl
- Not applicable, substance is a UVCB.
Molecular and structural information
- Molecular formula:
- Representative molecular formula of the major constituents, as the substance is an UVCB:
C12 TMAC: C15H34CL1N1
C14 TMAC: C17H38CL1N1
C16 TMAC: C19H42CL1N1
C18 TMAC: C21H46CL1N1 - Molecular weight:
- ca. 263.9 - ca. 348.06
- SMILES notation:
- Representative SMILES of the major constituents, as the substance is an UVCB:
C12 TMAC: CN(CL)(C)(C)CCCCCCCCCCCC
C14 TMAC: CN(CL)(C)(C)CCCCCCCCCCCCCC
C16 TMAC: CN(CL)(C)(C)CCCCCCCCCCCCCCCC
C18 TMAC: CN(CL)(C)(C)CCCCCCCCCCCCCCCCCC - InChl:
- Representative InChI of the major constituents, as the substance is an UVCB:
C12 TMAC: 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
C14 TMAC: 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
C16 TMAC: 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
C18 TMAC: 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:
Related substances
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Information on Registered Substances comes from registration dossiers which have been assigned a registration number. The assignment of a registration number does however not guarantee that the information in the dossier is correct or that the dossier is compliant with Regulation (EC) No 1907/2006 (the REACH Regulation). This information has not been reviewed or verified by the Agency or any other authority. The content is subject to change without prior notice.
Reproduction or further distribution of this information may be subject to copyright protection. Use of the information without obtaining the permission from the owner(s) of the respective information might violate the rights of the owner.
