ChemSpider 2D Image | {2-[(E)-({(2E)-2-[(2-Chlorobenzoyl)amino]-3-[4-(diethylamino)phenyl]-2-propenoyl}hydrazono)methyl]phenoxy}acetic acid | C29H29ClN4O5

{2-[(E)-({(2E)-2-[(2-Chlorobenzoyl)amino]-3-[4-(diethylamino)phenyl]-2-propenoyl}hydrazono)methyl]phenoxy}acetic acid

  • Molecular FormulaC29H29ClN4O5
  • Average mass549.017 Da
  • Monoisotopic mass548.182678 Da
  • ChemSpider ID21259552

  • Double-bond stereo - Double-bond stereo

More details:

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

{2-[(E)-({(2E)-2-[(2-Chlorbenzoyl)amino]-3-[4-(diethylamino)phenyl]-2-propenoyl}hydrazono)methyl]phenoxy}essigsäure [German] [ACD/IUPAC Name]
{2-[(E)-({(2E)-2-[(2-Chlorobenzoyl)amino]-3-[4-(diethylamino)phenyl]-2-propenoyl}hydrazono)methyl]phenoxy}acetic acid [ACD/IUPAC Name]
{2-[(E)-({(2E)-2-[(2-Chlorobenzoyl)amino]-3-[4-(diethylamino)phenyl]prop-2-enoyl}hydrazono)methyl]phenoxy}acetic acid
{2-[(E)-(2-{(2E)-2-[(2-chlorobenzoyl)amino]-3-[4-(diethylamino)phenyl]prop-2-enoyl}hydrazinylidene)methyl]phenoxy}acetic acid
2-Propenoic acid, 2-[(2-chlorobenzoyl)amino]-3-[4-(diethylamino)phenyl]-, 1-[2-[(1E)-[2-(carboxymethoxy)phenyl]methylene]hydrazide], (2E)- [ACD/Index Name]
Acide {2-[(E)-({(2E)-2-[(2-chlorobenzoyl)amino]-3-[4-(diéthylamino)phényl]-2-propenoyl}hydrazono)méthyl]phénoxy}acétique [French] [ACD/IUPAC Name]
(2-{[2-(2-Chloro-benzoylamino)-3-(4-diethylamino-phenyl)-acryloyl]-hydrazonomethyl}-phenoxy)-acetic acid
{2-[(E)-(2-{(2E)-2-{[(2-chlorophenyl)carbonyl]amino}-3-[4-(diethylamino)phenyl]prop-2-enoyl}hydrazinylidene)methyl]phenoxy}acetic acid
2-[(1E)-{[(2E)-2-[(2-CHLOROPHENYL)FORMAMIDO]-3-[4-(DIETHYLAMINO)PHENYL]PROP-2-ENAMIDO]IMINO}METHYL]PHENOXYACETIC ACID
2-{2-[(1E)-{[(2E)-2-[(2-CHLOROPHENYL)FORMAMIDO]-3-[4-(DIETHYLAMINO)PHENYL]PROP-2-ENAMIDO]IMINO}METHYL]PHENOXY}ACETIC ACID

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: 1.599
Molar Refractivity: 150.7±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 5.89
ACD/LogD (pH 5.5): 2.35
ACD/BCF (pH 5.5): 9.18
ACD/KOC (pH 5.5): 33.91
ACD/LogD (pH 7.4): 1.20
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.41
Polar Surface Area: 120 Å2
Polarizability: 59.7±0.5 10-24cm3
Surface Tension: 47.5±7.0 dyne/cm
Molar Volume: 441.3±7.0 cm3

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