Found 99 results

Search term: MF = 'C_{29}H_{31}N_{7}O_{4}S'
ChemSpider 2D Image | Ethyl (2E)-3-{4-[(E)-2-(5-{(E)-[2-acetamido-4-(diethylamino)-5-methoxyphenyl]diazenyl}-1,3,4-thiadiazol-2-yl)vinyl]phenyl}-2-cyanoacrylate | C29H31N7O4S

Ethyl (2E)-3-{4-[(E)-2-(5-{(E)-[2-acetamido-4-(diethylamino)-5-methoxyphenyl]diazenyl}-1,3,4-thiadiazol-2-yl)vinyl]phenyl}-2-cyanoacrylate

  • Molecular FormulaC29H31N7O4S
  • Average mass573.666 Da
  • Monoisotopic mass573.215820 Da
  • ChemSpider ID8778571

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-{4-[(E)-2-(5-{(E)-[2-Acétamido-4-(diéthylamino)-5-méthoxyphényl]diazényl}-1,3,4-thiadiazol-2-yl)vinyl]phényl}-2-cyanoacrylate d'éthyle [French] [ACD/IUPAC Name]
2-Propenoic acid, 3-[4-[(E)-2-[5-[(E)-2-[2-(acetylamino)-4-(diethylamino)-5-methoxyphenyl]diazenyl]-1,3,4-thiadiazol-2-yl]ethenyl]phenyl]-2-cyano-, ethyl ester, (2E)- [ACD/Index Name]
Ethyl (2E)-3-{4-[(E)-2-(5-{(E)-[2-acetamido-4-(diethylamino)-5-methoxyphenyl]diazenyl}-1,3,4-thiadiazol-2-yl)vinyl]phenyl}-2-cyanoacrylate [ACD/IUPAC Name]
Ethyl-(2E)-3-{4-[(E)-2-(5-{(E)-[2-acetamido-4-(diethylamino)-5-methoxyphenyl]diazenyl}-1,3,4-thiadiazol-2-yl)vinyl]phenyl}-2-cyanacrylat [German] [ACD/IUPAC Name]

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: 1.614
Molar Refractivity: 161.1±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: 5.86
ACD/LogD (pH 5.5): 5.54
ACD/BCF (pH 5.5): 9474.95
ACD/KOC (pH 5.5): 24235.01
ACD/LogD (pH 7.4): 5.55
ACD/BCF (pH 7.4): 9750.14
ACD/KOC (pH 7.4): 24938.93
Polar Surface Area: 170 Å2
Polarizability: 63.9±0.5 10-24cm3
Surface Tension: 47.3±7.0 dyne/cm
Molar Volume: 461.9±7.0 cm3

Click to predict properties on the Chemicalize site


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