ChemSpider 2D Image | 2-Methyl-2-propanyl (4-{(2E)-2-[6'-(4-methoxyphenyl)-3',4'-dihydro-8'H-spiro[cyclohexane-1,2'-pyrano[3,2-g]chromen]-8'-ylidene]hydrazino}-4-oxobutyl)carbamate | C33H41N3O6

2-Methyl-2-propanyl (4-{(2E)-2-[6'-(4-methoxyphenyl)-3',4'-dihydro-8'H-spiro[cyclohexane-1,2'-pyrano[3,2-g]chromen]-8'-ylidene]hydrazino}-4-oxobutyl)carbamate

  • Molecular FormulaC33H41N3O6
  • Average mass575.695 Da
  • Monoisotopic mass575.299561 Da
  • ChemSpider ID21859109

  • Double-bond stereo - Double-bond stereo

More details:

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

2-Methyl-2-propanyl (4-{(2E)-2-[6'-(4-methoxyphenyl)-3',4'-dihydro-8'H-spiro[cyclohexane-1,2'-pyrano[3,2-g]chromen]-8'-ylidene]hydrazino}-4-oxobutyl)carbamate [ACD/IUPAC Name]
Butanoic acid, 4-[[(1,1-dimethylethoxy)carbonyl]amino]-, 2-[(8E)-3,4-dihydro-6-(4-methoxyphenyl)spiro[2H,8H-benzo[1,2-b:5,4-b']dipyran-2,1'-cyclohexan]-8-ylidene]hydrazide [ACD/Index Name]
(E)-tert-butyl (4-(2-(6'-(4-methoxyphenyl)-3'H-spiro[cyclohexane-1,2'-pyrano[3,2-g]chromen]-8'(4'H)-ylidene)hydrazinyl)-4-oxobutyl)carbamate
tert-butyl (4-{(2E)-2-[6'-(4-methoxyphenyl)-3',4'-dihydro-8'H-spiro[cyclohexane-1,2'-pyrano[3,2-g]chromen]-8'-ylidene]hydrazino}-4-oxobutyl)carbamate
tert-butyl (4-{(2E)-2-[6'-(4-methoxyphenyl)-3',4'-dihydro-8'H-spiro[cyclohexane-1,2'-pyrano[3,2-g]chromen]-8'-ylidene]hydrazinyl}-4-oxobutyl)carbamate

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: 1.602
Molar Refractivity: 158.6±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 8.50
ACD/LogD (pH 5.5): 7.58
ACD/BCF (pH 5.5): 338426.78
ACD/KOC (pH 5.5): 315910.59
ACD/LogD (pH 7.4): 7.58
ACD/BCF (pH 7.4): 338344.31
ACD/KOC (pH 7.4): 315833.59
Polar Surface Area: 107 Å2
Polarizability: 62.9±0.5 10-24cm3
Surface Tension: 45.7±7.0 dyne/cm
Molar Volume: 462.2±7.0 cm3

Click to predict properties on the Chemicalize site


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