Registration Dossier
Registration Dossier
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EC number: 246-771-9 | CAS number: 25265-77-4
Reference substances
- IUPAC name:
- 3-hydoxy-2,2,4-trimethylpentyl isobutyrate
Inventory
- EC number:
- 201-049-2
- EC name:
- 3-hydroxy-2,2,4-trimethylpentyl isobutyrate
- CAS number:
- 77-68-9
- CAS number:
- 77-68-9
Synonyms
- Names:
- 1,3-Pentanediol, 2,2,4-trimethyl-, 1-isobutyrate
- 2,2,4-Trimethyl-1,3-pentanediol 1-isobutyrate
- Isobutyric acid, 3-hydroxy-2,2,4-trimethylpentyl ester
- Propanoic acid, 2-methyl-, 3-hydroxy-2,2,4-trimethylpentyl ester
- Identifier:
- IUPAC name
- (3-hydroxy-2,2,4-trimethylpentyl) 2-methylpropanoate
- Identifier:
- IUPAC name
- 3-hydoxy-2,2,4-trimethylpentyl acetate
- Identifier:
- IUPAC name
- 3-hydroxy-2,2,4-trimethylpentyl 2-methyl propanoate
- Identifier:
- IUPAC name
- 3-hydroxy-2,2,4-trimethylpentyl 2-methylpropanoate
- Identifier:
- IUPAC name
- 3-hydroxy-2,2,4-trimethylpentyl isobutyrate
- Identifier:
- other: SMILES notation
- CC(C)C(=O)OCC(C)(C)C(C(C)C)O
- Identifier:
- other: SMILES notation
- CC(C)C(C(C)(C)COC(=O)C(C)C)O
- Identifier:
- other: SMILES notation
- CC(C)C(O)C(C)(C)COC(=O)C(C)C
- Identifier:
- other: InChl
- InChI=1/C12H24O3/c1-8(2)10(13)12(5,6)7-15-11(14)9(3)4/h8-10,13H,7H2,1-6H3
Molecular and structural information
- Molecular formula:
- C12H24O3
- Molecular weight:
- > 216 - < 217
- SMILES notation:
- CC(C)C(OCC(C)(C)C(O)C(C)C)=O
- InChl:
- InChI=1S/C12H24O3/c1-8(2)10(13)12(5,6)7-15-11(14)9(3)4/h8-10,13H,7H2,1-6H3
- 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.
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.
