chempirical

Bisoctrizole

C41H50N6O2CAS 103597-45-1658.89 g/mol

Open in Covalent MOL file
NNNOHOHNNN
Phenol

Properties

Molecular formula
C41H50N6O2
Molar mass
658.89 g/mol
Exact mass
658.3995 Da
Melting point
200 °C
logP
9.58Crippen estimate
Polar surface area
101.9 Ų
H-bond donors / acceptors
2 / 6
Rotatable bonds
8

Hazards

Harmonised EU classification (CLP Annex VI), via PubChem.

Precautionary statements

P273, P501

Identifiers

CAS number
103597-45-1
SMILES
CC(C)(C)CC(C)(C)c1cc(Cc2cc(C(C)(C)CC(C)(C)C)cc(-n3nc4ccccc4n3)c2O)c(O)c(-n2nc3ccccc3n2)c1
InChIKey
FQUNFJULCYSSOP-UHFFFAOYSA-N
InChI
InChI=1S/C41H50N6O2/c1-38(2,3)24-40(7,8)28-20-26(36(48)34(22-28)46-42-30-15-11-12-16-31(30)43-46)19-27-21-29(41(9,10)25-39(4,5)6)23-35(37(27)49)47-44-32-17-13-14-18-33(32)45-47/h11-18,20-23,48-49H,19,24-25H2,1-10H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

40 names · show all
  • Phenol, 2,2′-methylenebis[6-(2H-benzotriazol-2-yl)-4-(1,1,3,3-tetramethylbutyl)-
  • 2,2′-Methylenebis[6-(2H-benzotriazol-2-yl)-4-(1,1,3,3-tetramethylbutyl)phenol]
  • 2,2′-Methylenebis[4-(1,1,3,3-tetramethylbutyl)-6-benzotriazolylphenol]
  • Mark LA 31
  • Mixxim BB 100
  • ADK Stab LA 31
  • LA 31
  • 2,2′-Methylenebis[4-(1,1,3,3-tetramethylbutyl)-6-(2H-benzotriazol-2-yl)phenol]
  • Tinuvin 360
  • 2,2′-Methylenebis[6-(2-benzotriazolyl)-4-(1,1,3,3-tetramethylbutyl)phenol]
  • Bis[2-hydroxy-5-tert-octyl-3-(benzotriazol-2-yl)phenyl]methane
  • Tinosorb M
  • Methylenebis(2-hydroxy-3-(benzotriazol-2-yl)-5-tert-octylphenyl)
  • Bisoctyltriazole
  • MBBT
  • FAT 75′634
  • 2,2′-Methylenebis[4-(1,1,3,3-tetramethylbutyl)-6-benzotriazol-2-ylphenol]
  • Eversorb 78
  • Mixxim ADK LA 31
  • JF 832
  • UV 360
  • 2,2′-Methylenebis[6-(2H-benzotriazol-2-yl)-4-tert-octylphenol]
  • Chiguard 5431
  • ADK Stab LA 31RG
  • LA 31RG
  • ADK Stab LA 31R
  • ADK-ARKLS LA 31
  • ZINC 11677911
  • 2,2′-Methylenebis(4-tert-octyl-6-benzotriazol-2-ylphenol)
  • Kemisorb 279
  • 2,2′-Methylenebis[6-(2H-benzotriazole-2-yl)-4-tert-octylphenol]
  • Bis[2-hydroxy-5-tert-octyl-3-(benzotriazole-2-yl)phenyl]methane
  • Tinuvin 360ED
  • Tinuvin 5431
  • UV 5431
  • UC 3125
  • Adeka nol UC 3125
  • Chisorb 5431
  • 2,2′-Methylene-bis-(6-(2H-benzotriazol-2-yl)-4-(1,1,3,3-tetramethylbutyl)phenol)
  • T 360

Work with Bisoctrizole

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-(2H-Benzotriazol-2-yl)-6-(1-methyl-1-phenylethyl)-4-(1,1,3,3-tetramethylbutyl)phenol73936-91-169 % similar 2-(2-Hydroxy-5-tert-octylphenyl)benzotriazole123307-21-165 % similar 2-(2-Hydroxy-5-tert-octylphenyl)benzotriazole3147-75-965 % similar Uv-32825973-55-158 % similar 2-(2'-Hydroxy-3'5-di-tert-butylphenyl) benzotriazole3846-71-751 % similar 2-(2H-Benzotriazol-2-yl)-4,6-bis(1-methyl-1-phenylethyl)phenol70321-86-748 % similar 2-(3-sec-Butyl-5-tert-butyl-2-hydroxyphenyl)benzotriazole36437-37-346 % similar 2-(2-Hydroxy-3-dodecyl-5-methylphenyl)benzotriazole23328-53-245 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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