ChemSpider 2D Image | 2-Methyl-2-butanyl [(1H-benzotriazol-1-ylacetyl)(2-methylbenzyl)amino](3-methoxyphenyl)acetate | C30H34N4O4

2-Methyl-2-butanyl [(1H-benzotriazol-1-ylacetyl)(2-methylbenzyl)amino](3-methoxyphenyl)acetate

  • Molecular FormulaC30H34N4O4
  • Average mass514.615 Da
  • Monoisotopic mass514.257996 Da
  • ChemSpider ID2479420

More details:

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

{[2-(1H-Benzotriazol-1-yl)acétyl](2-méthylbenzyl)amino}(3-méthoxyphényl)acétate de 2-méthyl-2-butanyle [French] [ACD/IUPAC Name]
2-Methyl-2-butanyl [(1H-benzotriazol-1-ylacetyl)(2-methylbenzyl)amino](3-methoxyphenyl)acetate [ACD/IUPAC Name]
2-Methyl-2-butanyl-[(1H-benzotriazol-1-ylacetyl)(2-methylbenzyl)amino](3-methoxyphenyl)acetat [German] [ACD/IUPAC Name]
Benzeneacetic acid, α-[[2-(1H-1,2,3-benzotriazol-1-yl)acetyl][(2-methylphenyl)methyl]amino]-3-methoxy-, 1,1-dimethylpropyl ester [ACD/Index Name]

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

ASN 07438977 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 689.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.1±3.0 kJ/mol
Flash Point: 371.0±31.5 °C
Index of Refraction: 1.591
Molar Refractivity: 148.7±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 7.30
ACD/LogD (pH 5.5): 5.68
ACD/BCF (pH 5.5): 12311.33
ACD/KOC (pH 5.5): 29472.83
ACD/LogD (pH 7.4): 5.68
ACD/BCF (pH 7.4): 12311.98
ACD/KOC (pH 7.4): 29474.38
Polar Surface Area: 87 Å2
Polarizability: 59.0±0.5 10-24cm3
Surface Tension: 43.1±7.0 dyne/cm
Molar Volume: 440.4±7.0 cm3

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