ChemSpider 2D Image | (5E,7R)-6,7-Dimethyl-4-oxa-8-thia-2,5-diazanon-5-en-3-one 8,8-dioxide | C7H14N2O4S

(5E,7R)-6,7-Dimethyl-4-oxa-8-thia-2,5-diazanon-5-en-3-one 8,8-dioxide

  • Molecular FormulaC7H14N2O4S
  • Average mass222.262 Da
  • Monoisotopic mass222.067429 Da
  • ChemSpider ID34989571

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(5E,7R) 8,8-Dioxyde de 6,7-diméthyl-4-oxa-8-thia-2,5-diazanon-5-én-3-one [French] [ACD/IUPAC Name]
(5E,7R)-6,7-Dimethyl-4-oxa-8-thia-2,5-diazanon-5-en-3-on-8,8-dioxid [German] [ACD/IUPAC Name]
(5E,7R)-6,7-Dimethyl-4-oxa-8-thia-2,5-diazanon-5-en-3-one 8,8-dioxide [ACD/IUPAC Name]
2-Butanone, 3-(methylsulfonyl)-, O-[(methylamino)carbonyl]oxime, (2E,3R)- [ACD/Index Name]
252-140-9 [EINECS]
34681-23-7 [RN]
Butoxycarboxim [ISO]
UNII-C51715874E

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.507
Molar Refractivity: 52.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.72
ACD/LogD (pH 5.5): -0.47
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 13.29
ACD/LogD (pH 7.4): -0.47
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 13.29
Polar Surface Area: 93 Å2
Polarizability: 20.7±0.5 10-24cm3
Surface Tension: 39.7±7.0 dyne/cm
Molar Volume: 175.3±7.0 cm3

Click to predict properties on the Chemicalize site


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