Registration Dossier
Registration Dossier
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EC number: 601-141-6 | CAS number: 111937-03-2
Reference substances
- IUPAC name:
- octadecyl-7-methyloctanoate
Inventory
- EC number:
- 284-425-9
- EC name:
- Octadecyl isononanoate
- CAS number:
- 84878-34-2
- CAS number:
- 84878-34-2
Synonyms
- Names:
- Stearyl Isononanoate
- Identifier:
- IUPAC name
- Octadecyl isononanoate
- Identifier:
- IUPAC name
- ocadecyl 7-methyloctanoate
- Identifier:
- IUPAC name
- octadecyl 3,5,5-trimethylhexanoate
- Identifier:
- IUPAC name
- octadecyl 7-methyloctanoate
- Identifier:
- IUPAC name
- octadecyl isononanoate
- Identifier:
- other: Molecular formula
- C27H54O2
- Identifier:
- other: SMILES notation
- CC(C)(C)CC(C)CC(OCCCCCCCCCCCCCCCCCC)=O
- Identifier:
- other: SMILES notation
- CCCCCCCCCCCCCCCCCCOC(=O)CC(C)CC(C)(C)C CCCCCCCCCCCCCCCCCCOC(=O)CC(C)CC(C)(C)C
- Identifier:
- other: SMILES notation
- CCCCCCCCCCCCCCCCCCOC(=O)CCCCCC(C)C
- Identifier:
- other: InChl
- InChI=1S/C27H54O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-29-27(28)24-21-19-20-23-26(2)3/h26H,4-25H2,1-3H3
- Identifier:
- other: InChl
- InChI=1S/C27H54O2/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-29-26(28)23-25(2)24-27(3,4)5/h25H,6-24H2,1-5H3
Molecular and structural information
- Molecular formula:
- C27 H54 O2
- Molecular weight:
- 410.722
- SMILES notation:
- CCCCCCCCCCCCCCCCCCOC(=O)CC(C)CC(C)(C)C
- InChl:
- InChI=1/C27H56O2/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-29-26(28)23-25(2)24-27(3,4)5/h25-26,28H,6-24H2,1-5H3
- Structural formula:
Related substances
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.
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