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Search term: HSOHOSHTLFGGTH-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-Cyclopentyl-N-(3-isopropyl-2-sulfanylbenzoyl)glycine | C17H23NO3S

N-Cyclopentyl-N-(3-isopropyl-2-sulfanylbenzoyl)glycine

  • Molecular FormulaC17H23NO3S
  • Average mass321.434 Da
  • Monoisotopic mass321.139862 Da
  • ChemSpider ID23197041

More details:

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

Glycine, N-cyclopentyl-N-[2-mercapto-3-(1-methylethyl)benzoyl]- [ACD/Index Name]
N-Cyclopentyl-N-(3-isopropyl-2-sulfanylbenzoyl)glycin [German] [ACD/IUPAC Name]
N-Cyclopentyl-N-(3-isopropyl-2-sulfanylbenzoyl)glycine [ACD/IUPAC Name]
N-Cyclopentyl-N-(3-isopropyl-2-sulfanylbenzoyl)glycine [French] [ACD/IUPAC Name]
N-cyclopentyl-N-[3-(propan-2-yl)-2-sulfanylbenzoyl]glycine
[Cyclopentyl-(3-isopropyl-2-mercapto-benzoyl)-amino]-acetic acid
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL325305/

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

Density: 1.2±0.1 g/cm3
Boiling Point: 529.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.6±3.0 kJ/mol
Flash Point: 273.8±30.1 °C
Index of Refraction: 1.590
Molar Refractivity: 89.1±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.40
ACD/LogD (pH 5.5): 0.75
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.18
ACD/LogD (pH 7.4): -1.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 96 Å2
Polarizability: 35.3±0.5 10-24cm3
Surface Tension: 53.4±5.0 dyne/cm
Molar Volume: 264.1±5.0 cm3

Click to predict properties on the Chemicalize site


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