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Search term: SHGBDJPKHKFBFJ-CHHPPJJSCT (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2-[(1-Bromo-2-naphthyl)oxy]-N-{[2-(3-iodo-4-methoxybenzoyl)hydrazino]carbonothioyl}acetamide | C21H17BrIN3O4S

2-[(1-Bromo-2-naphthyl)oxy]-N-{[2-(3-iodo-4-methoxybenzoyl)hydrazino]carbonothioyl}acetamide

  • Molecular FormulaC21H17BrIN3O4S
  • Average mass614.251 Da
  • Monoisotopic mass612.916748 Da
  • ChemSpider ID3692609

More details:

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

2-[(1-Brom-2-naphthyl)oxy]-N-{[2-(3-iod-4-methoxybenzoyl)hydrazino]carbonothioyl}acetamid [German] [ACD/IUPAC Name]
2-[(1-Bromo-2-naphthyl)oxy]-N-{[2-(3-iodo-4-methoxybenzoyl)hydrazino]carbonothioyl}acetamide [ACD/IUPAC Name]
2-[(1-Bromo-2-naphtyl)oxy]-N-{[2-(3-iodo-4-méthoxybenzoyl)hydrazino]carbonothioyl}acétamide [French] [ACD/IUPAC Name]
Benzoic acid, 3-iodo-4-methoxy-, 2-[[[2-[(1-bromo-2-naphthalenyl)oxy]acetyl]amino]thioxomethyl]hydrazide [ACD/Index Name]
N-[({2-[(1-BROMONAPHTHALEN-2-YL)OXY]ACETAMIDO}METHANETHIOYL)AMINO]-3-IODO-4-METHOXYBENZAMIDE

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

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.705
Molar Refractivity: 135.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 5.43
ACD/LogD (pH 5.5): 4.38
ACD/BCF (pH 5.5): 1250.16
ACD/KOC (pH 5.5): 5702.01
ACD/LogD (pH 7.4): 3.99
ACD/BCF (pH 7.4): 504.30
ACD/KOC (pH 7.4): 2300.15
Polar Surface Area: 121 Å2
Polarizability: 53.5±0.5 10-24cm3
Surface Tension: 65.0±3.0 dyne/cm
Molar Volume: 347.3±3.0 cm3

Click to predict properties on the Chemicalize site


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