Found 38 results

Search term: MF = 'C_{21}H_{16}Br_{2}N_{2}O_{2}S'
ChemSpider 2D Image | 1-(3,5-dibromo-2-methoxybenzoyl)-3-(1,2-dihydroacenaphthylen-5-yl)thiourea | C21H16Br2N2O2S

1-(3,5-dibromo-2-methoxybenzoyl)-3-(1,2-dihydroacenaphthylen-5-yl)thiourea

  • Molecular FormulaC21H16Br2N2O2S
  • Average mass520.237 Da
  • Monoisotopic mass517.929932 Da
  • ChemSpider ID2681349

More details:

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

1-(3,5-dibromo-2-methoxybenzoyl)-3-(1,2-dihydroacenaphthylen-5-yl)thiourea
3,5-Dibrom-N-(1,2-dihydro-5-acenaphthylenylcarbamothioyl)-2-methoxybenzamid [German] [ACD/IUPAC Name]
3,5-Dibromo-N-(1,2-dihydro-5-acenaphthylenylcarbamothioyl)-2-methoxybenzamide [ACD/IUPAC Name]
3,5-Dibromo-N-(1,2-dihydro-5-acénaphtylénylcarbamothioyl)-2-méthoxybenzamide [French] [ACD/IUPAC Name]
Benzamide, 3,5-dibromo-N-[[(1,2-dihydro-5-acenaphthylenyl)amino]thioxomethyl]-2-methoxy- [ACD/Index Name]
1-Acenaphthen-5-yl-3-(3,5-dibromo-2-methoxy-benzoyl)-thiourea
3,5-dibromo-N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-2-methoxybenzamide

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

ZINC04089867 [DBID]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.761
Molar Refractivity: 123.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 6.47
ACD/LogD (pH 5.5): 5.83
ACD/BCF (pH 5.5): 15859.02
ACD/KOC (pH 5.5): 35084.71
ACD/LogD (pH 7.4): 5.38
ACD/BCF (pH 7.4): 5539.12
ACD/KOC (pH 7.4): 12254.13
Polar Surface Area: 82 Å2
Polarizability: 49.1±0.5 10-24cm3
Surface Tension: 69.9±3.0 dyne/cm
Molar Volume: 300.5±3.0 cm3

Click to predict properties on the Chemicalize site


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