Found 29 results

Search term: MF = 'C_{15}H_{13}N_{2}O_{6}S'
ChemSpider 2D Image | (7Z)-3-(Methoxymethyl)-8-oxo-7-(2-pyridinylmethylene)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate 5,5-dioxide | C15H13N2O6S

(7Z)-3-(Methoxymethyl)-8-oxo-7-(2-pyridinylmethylene)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate 5,5-dioxide

  • Molecular FormulaC15H13N2O6S
  • Average mass349.339 Da
  • Monoisotopic mass349.049988 Da
  • ChemSpider ID34975631

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

More details:

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

(7Z) 5,5-Dioxyde de 3-(méthoxyméthyl)-8-oxo-7-(2-pyridinylméthylène)-5-thia-1-azabicyclo[4.2.0]oct-2-ène-2-carboxylate [French] [ACD/IUPAC Name]
(7Z)-3-(Methoxymethyl)-8-oxo-7-(2-pyridinylmethylen)-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-carboxylat-5,5-dioxid [German] [ACD/IUPAC Name]
(7Z)-3-(Methoxymethyl)-8-oxo-7-(2-pyridinylmethylene)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate 5,5-dioxide [ACD/IUPAC Name]
5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 3-(methoxymethyl)-8-oxo-7-(2-pyridinylmethylene)-, ion(1-), 5,5-dioxide, (7Z)- [ACD/Index Name]
CHEMBL353978

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

Density:
Boiling Point: 722.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.7±3.0 kJ/mol
Flash Point: 390.5±32.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.19
ACD/LogD (pH 5.5): -2.32
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.34
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 125 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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