ChemSpider 2D Image | Bemotrizinol | C38H49N3O5

Bemotrizinol

  • Molecular FormulaC38H49N3O5
  • Average mass627.813 Da
  • Monoisotopic mass627.367249 Da
  • ChemSpider ID10128615

  • Double-bond stereo - Double-bond stereo

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

Bemotrizinol [INN] [USAN] [Wiki] [REDIRECT]
(6Z,6'Z)-6,6'-[6-(4-Methoxyphenyl)-1,3,5-triazin-2,4(1H,3H)-diyliden]bis{3-[(2-ethylhexyl)oxy]-2,4-cyclohexadien-1-on} [German] [ACD/IUPAC Name]
(6Z,6'Z)-6,6'-[6-(4-Methoxyphenyl)-1,3,5-triazine-2,4(1H,3H)-diylidene]bis{3-[(2-ethylhexyl)oxy]-2,4-cyclohexadien-1-one} [ACD/IUPAC Name]
(6Z,6'Z)-6,6'-[6-(4-Méthoxyphényl)-1,3,5-triazine-2,4(1H,3H)-diylidène]bis{3-[(2-éthylhexyl)oxy]-2,4-cyclohexadién-1-one} [French] [ACD/IUPAC Name]
187393-00-6 [RN]
2,4-Cyclohexadien-1-one, 6,6'-[6-(4-methoxyphenyl)-1,3,5-triazine-2,4(1H,3H)-diylidene]bis[3-[(2-ethylhexyl)oxy]-, (6Z,6'Z)- [ACD/Index Name]
Escalol S [Trade name]
Tinosorb S [Trade name]
(6Z,6'Z)-6,6'-(6-(4-methoxyphenyl)-1,3,5-triazine-2,4(1H,3H)-diylidene)bis(3-((2-ethylhexyl)oxy)cyclohexa-2,4-dien-1-one)
4-Phenyl-1,2,3,4-tetrahydroisoquinoline [ACD/IUPAC Name]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

D03227 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 771.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 112.3±3.0 kJ/mol
Flash Point: 420.2±32.9 °C
Index of Refraction: 1.571
Molar Refractivity: 181.6±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 2
ACD/LogP: 7.65
ACD/LogD (pH 5.5): 4.73
ACD/BCF (pH 5.5): 765.58
ACD/KOC (pH 5.5): 1096.31
ACD/LogD (pH 7.4): 5.12
ACD/BCF (pH 7.4): 1900.15
ACD/KOC (pH 7.4): 2721.01
Polar Surface Area: 98 Å2
Polarizability: 72.0±0.5 10-24cm3
Surface Tension: 40.3±7.0 dyne/cm
Molar Volume: 552.8±7.0 cm3

Click to predict properties on the Chemicalize site


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