ChemSpider 2D Image | 4-[(E)-({[4-(2,4,4-Trimethyl-2-pentanyl)phenoxy]acetyl}hydrazono)methyl]phenyl 4-nitrobenzoate | C30H33N3O6

4-[(E)-({[4-(2,4,4-Trimethyl-2-pentanyl)phenoxy]acetyl}hydrazono)methyl]phenyl 4-nitrobenzoate

  • Molecular FormulaC30H33N3O6
  • Average mass531.599 Da
  • Monoisotopic mass531.236938 Da
  • ChemSpider ID4761096

  • Double-bond stereo - Double-bond stereo

More details:

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

4-[(E)-({[4-(2,4,4-Trimethyl-2-pentanyl)phenoxy]acetyl}hydrazono)methyl]phenyl 4-nitrobenzoate [ACD/IUPAC Name]
4-[(E)-({[4-(2,4,4-Trimethyl-2-pentanyl)phenoxy]acetyl}hydrazono)methyl]phenyl-4-nitrobenzoat [German] [ACD/IUPAC Name]
4-[(E)-({[4-(2,4,4-Trimethylpentan-2-yl)phenoxy]acetyl}hydrazono)methyl]phenyl 4-nitrobenzoate
4-Nitrobenzoate de 4-[(E)-({2-[4-(2,4,4-triméthyl-2-pentanyl)phénoxy]acétyl}hydrazono)méthyl]phényle [French] [ACD/IUPAC Name]
Benzoic acid, 4-nitro-, 4-[(E)-[2-[2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]acetyl]hydrazinylidene]methyl]phenyl ester [ACD/Index Name]
4-((1E)-2-{2-[4-(1,1,3,3-tetramethylbutyl)phenoxy]acetylamino}-2-azavinyl)phenyl 4-nitrobenzoate
4-[(E)-(2-{[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetyl}hydrazinylidene)methyl]phenyl 4-nitrobenzoate
4-Nitro-benzoic acid 4-({2-[4-(1,1,3,3-tetramethyl-butyl)-phenoxy]-acetyl}-hydrazonomethyl)-phenyl ester

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

A0423/0019577 [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.567
Molar Refractivity: 149.6±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 8.59
ACD/LogD (pH 5.5): 7.48
ACD/BCF (pH 5.5): 282891.63
ACD/KOC (pH 5.5): 277871.41
ACD/LogD (pH 7.4): 7.48
ACD/BCF (pH 7.4): 282881.69
ACD/KOC (pH 7.4): 277861.63
Polar Surface Area: 123 Å2
Polarizability: 59.3±0.5 10-24cm3
Surface Tension: 43.4±7.0 dyne/cm
Molar Volume: 458.0±7.0 cm3

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