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2-(2-hydroxy-3-methyl-5-tert-butylphenyl)-2H-benzotriazole

HCID 13580802
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
Cc1cc(C(C)(C)C)cc(-n2nc3ccccc3n2)c1O
InChIKey
NLWDAUDWBLSJGK-UHFFFAOYSA-N
Molecular formula
C17H19N3O
Average molar mass
281.35 g/mol
Monoisotopic mass
281.15281224

Names & identifiers

Preferred name
2-(2-hydroxy-3-methyl-5-tert-butylphenyl)-2H-benzotriazole
IUPAC
2-(benzotriazol-2-yl)-4-tert-butyl-6-methylphenol

Names & synonyms

SCHEMBL108807SCHEMBL9408718SCHEMBL29813370NLWDAUDWBLSJGK-UHFFFAOYSA-N2-(2-hydroxy-3-methyl-5-tert-butylphenyl)-2H-benzotriazole

Database identifiers

PubChem CID
13580802

Properties

Computed structural properties

XLogP
6
Topological polar surface area
50.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
21
Formal charge
0
Complexity
354

Related reactions

1 records
New reaction record
HRID 441513 reaction equation
HRID 441513As productuspto-grants-1977_08

Compound notes

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