Registration Dossier
Registration Dossier
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EC number: 249-060-1 | CAS number: 28510-23-8
Reference substances
- IUPAC name:
- 2,2-dimethylpropane-1,3-diyl bis(2-ethylhexanoate)
Inventory
- EC number:
- 249-060-1
- EC name:
- 2,2-dimethylpropane-1,3-diyl 2-ethylhexanoate
- CAS number:
- 28510-23-8
- CAS number:
- 28510-23-8
Synonyms
- Names:
- Hexanoic acid, 2-ethyl-, 2,2-dimethyl-1,3-propanediyl ester
- Identifier:
- IUPAC name
- 3-[(2-ethylhexanoyl)oxy]-2,2-dimethylpropyl 2-ethylheptanoate
- Identifier:
- other: SMILES notation
- CC(C)(COC(=O)C(CC)CCCC)COC(=O)C(CCCC)CC
- Identifier:
- other: InChl
- InChI=1S/C21H40O4/c1-7-11-13-17(9-3)19(22)24-15-21(5,6)16-25-20(23)18(10-4)14-12-8-2/h17-18H,7-16H2,1-6H3
- Identifier:
- other: SMILES notation
- O=C(OCC(C)(C)COC(=O)C(CC)CCCC)C(CC)CCCC
- 2,2-dimethylpropane-1,3-diyl bis(2-ethylhexanoate)
Molecular and structural information
- Molecular formula:
- C21H40O4
- Molecular weight:
- 356.54
- SMILES notation:
- CCCCC(CC)C(=O)OCC(C)(C)COC(=O)C(CC)CCCC
- InChl:
- InChI=1/C21H40O4/c1-7-11-13-17(9-3)19(22)24-15-21(5,6)16-25-20(23)18(10-4)14-12-8-2/h17-18H,7-16H2,1-6H3
- Structural formula:
Related substances
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