ChemSpider 2D Image | clavatadine E | C14H20BrN5O3

clavatadine E

  • Molecular FormulaC14H20BrN5O3
  • Average mass386.244 Da
  • Monoisotopic mass385.074951 Da
  • ChemSpider ID24623634

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-(3-Brom-4-hydroxyphenyl)-N-(4-carbamimidamidobutyl)-2-(hydroxyimino)propanamid [German] [ACD/IUPAC Name]
(2E)-3-(3-Bromo-4-hydroxyphenyl)-N-(4-carbamimidamidobutyl)-2-(hydroxyimino)propanamide [ACD/IUPAC Name]
(2E)-3-(3-Bromo-4-hydroxyphényl)-N-(4-carbamimidamidobutyl)-2-(hydroxyimino)propanamide [French] [ACD/IUPAC Name]
Benzenepropanamide, N-[4-[(aminoiminomethyl)amino]butyl]-3-bromo-4-hydroxy-α-(hydroxyimino)-, (αE)- [ACD/Index Name]
clavatadine E

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.645
Molar Refractivity: 87.6±0.5 cm3
#H bond acceptors: 8
#H bond donors: 7
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 0.50
ACD/LogD (pH 5.5): -1.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 144 Å2
Polarizability: 34.7±0.5 10-24cm3
Surface Tension: 60.7±7.0 dyne/cm
Molar Volume: 241.6±7.0 cm3

Click to predict properties on the Chemicalize site


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