Registration Dossier
Registration Dossier
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EC number: 267-342-2 | CAS number: 67845-93-6
Reference substances
- IUPAC name:
- hexadecyl 3,5-di-tert-butyl-4-hydroxybenzoate
Inventory
- EC number:
- 267-342-2
- EC name:
- Hexadecyl 3,5-bis-tert-butyl-4-hydroxybenzoate
- CAS number:
- 67845-93-6
- CAS number:
- 67845-93-6
Synonyms
- Names:
- Benzoic acid, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, hexadecyl ester
- Identifier:
- EC number
- 267-342-2
- Identifier:
- IUPAC name
- Hexadecyl 3,5-bis-tert-butyl-4-hydroxybenzoate
- Identifier:
- IUPAC name
- hexadecyl 3,5-bis-tert-butyl-4-hydroxybenzoate
- Identifier:
- IUPAC name
- hexadecyl 3,5-di-tert-butyl-4-hydroxybenzoate
- Identifier:
- other: SMILES notation
- O=C(OCCCCCCCCCCCCCCCC)c(cc(c(O)c1C(C)(C)C)C(C)(C)C)c1
- Identifier:
- other: Molecular formula
- C31H54O3
- Identifier:
- other: SMILES notation
- CCCCCCCCCCCCCCCCOC(=O)C1=CC(=C(O)C(=C1)C(C)(C)C)C(C)(C)C
- Identifier:
- other: SMILES notation
- CCCCCCCCCCCCCCCCOC(=O)c1cc(c(O)c(c1)C(C)(C)C)C(C)(C)C
- Identifier:
- other: InChl
- InChI=1S/C31H54O3/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-34-29(33)25-23-26(30(2,3)4)28(32)27(24-25)31(5,6)7/h23-24,32H,8-22H2,1-7H3
- 3,5-Di-(t-Butyl)-4-hydroxy benzoic acid, hexadecyl ester
Molecular and structural information
- Molecular formula:
- C31H5403
- Molecular weight:
- 474.82
- SMILES notation:
- O=C(OCCCCCCCCCCCCCCCC)c(cc(c(O)c1C(C)(C)C)C(C)(C)C)c1
- InChl:
- InChI=1/C31H54O3/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-34-29(33)25-23-26(30(2,3)4)28(32)27(24-25)31(5,6)7/h23-24,32H,8-22H2,1-7H3
- 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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