Registration Dossier
Registration Dossier
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EC number: 287-488-0 | CAS number: 85536-07-8
Reference substances
- IUPAC name:
- octanoic acid, monoester with glycerol
Inventory
- EC number:
- 247-668-1
- EC name:
- Octanoic acid, monoester with glycerol
- CAS number:
- 26402-26-6
- CAS number:
- 26402-26-6
Synonyms
- Names:
- Octanoic acid, monoester with 1,2,3-propanetriol
- Identifier:
- IUPAC name
- 2,3-dihydroxypropyl octanoate
- Identifier:
- other: InChl
- 1S/C11H22O4/c1-2-3-4-5-6-7-11(14)15-9-10(13)8-12/h10,12-13H,2-9H2,1H3
- Identifier:
- other: SMILES notation
- CCCCCCCC(=O)OCC(CO)O
- Identifier:
- other: SMILES notation
- CCCCCCCC(=O)OCC(O)CO
- Identifier:
- other: SMILES notation
- CCCCCCCC(=O)OCC(O)CO CCCCCCCC(=O)OC(CO)CO
- Identifier:
- other: InChl
- InChI=1/C11H22O4/c1-2-3-4-5-6-7-11(14)15-9-10(13)8-12/h10,12-13H,2-9H2,1H3
- Identifier:
- other: InChl
- InChI=1S/C11H22O4/c1-2-3-4-5-6-7-11(14)15-9-10(13)8-12/h10,12-13H,2-9H2,1H3 InChI=1S/C11H22O4/c1-2-3-4-5-6-7-11(14)15-10(8-12)9-13/h10,12-13H,2-9H2, 1H3
Molecular and structural information
- Molecular formula:
- C11H22O4
- Molecular weight:
- ca. 218.29
- SMILES notation:
- CCCCCCCC(=O)OCC(O)CO
CCCCCCCC(=O)OC(CO)CO - InChl:
- InChI=1S/C11H22O4/c1-2-3-4-5-6-7-11(14)15-9-10(13)8-12/h10,12-13H,2-9H2,1H3
InChI=1S/C11H22O4/c1-2-3-4-5-6-7-11(14)15-10(8-12)9-13/h10,12-13H,2-9H2,1H3 - 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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