Basic information
- Standard SMILES
COC(=O)c1ccc2nn(-c3cc(C(C)(C)C)cc(C(C)(C)c4ccc(Cl)cc4)c3O)nc2c1- InChIKey
VLCHXMFVOWNART-UHFFFAOYSA-N- Molecular formula
- C27H28ClN3O3
- Average molar mass
- 478 g/mol
Names & identifiers
- Preferred name
- 5-Methoxycarbonyl2-[2-hydroxy-3-(4-chloro-alpha,alpha-dimethylbenzyl)-5-tert-butyl-phenyl]-2H-benzotriazole
- IUPAC
- methyl 2-[5-tert-butyl-3-[2-(4-chlorophenyl)propan-2-yl]-2-hydroxyphenyl]benzotriazole-5-carboxylate
Names & synonyms
SCHEMBL4823971VLCHXMFVOWNART-UHFFFAOYSA-N5-Methoxycarbonyl-2-(2-hydroxy-3-(4-chloro-alpha-cumyl)-5-tert-butylphenyl)-2H-benzotriazole5-Methoxycarbonyl2-[2-hydroxy-3-(4-chloro-alpha,alpha-dimethylbenzyl)-5-tert-butyl-phenyl]-2H-benzotriazole5-Methoxycarbonyl2-[2-hydroxy-3-(4-chloro-alpha,alpha-dimethylbenzyl)-5-tert-butylphenyl]-2H-benzotriazole
Database identifiers
- PubChem CID
- 22595032
Properties
Computed structural properties
- XLogP
- 7.9
- Topological polar surface area
- 77.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 718
Related reactions
6 records
Compound notes
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