ChemSpider 2D Image | 6,8-Dioxo-2-oxa-10-thia-5,7-diazadodecan-12-oic acid | C8H14N2O5S

6,8-Dioxo-2-oxa-10-thia-5,7-diazadodecan-12-oic acid

  • Molecular FormulaC8H14N2O5S
  • Average mass250.272 Da
  • Monoisotopic mass250.062347 Da
  • ChemSpider ID29279767

More details:

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

2-Oxa-10-thia-5,7-diazadodecan-12-oic acid, 6,8-dioxo- [ACD/Index Name]
6,8-Dioxo-2-oxa-10-thia-5,7-diazadodecan-12-oic acid [ACD/IUPAC Name]
6,8-Dioxo-2-oxa-10-thia-5,7-diazadodecan-12-säure [German] [ACD/IUPAC Name]
Acide 6,8-dioxo-2-oxa-10-thia-5,7-diazadodécan-12-oïque [French] [ACD/IUPAC Name]
[(2-{[(2-METHOXYETHYL)CARBAMOYL]AMINO}-2-OXOETHYL)SULFANYL]ACETIC ACID
2-[(2-{[(2-methoxyethyl)carbamoyl]amino}-2-oxoethyl)sulfanyl]acetic acid

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.528
Molar Refractivity: 57.7±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: -0.14
ACD/LogD (pH 5.5): -2.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.59
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 130 Å2
Polarizability: 22.9±0.5 10-24cm3
Surface Tension: 54.2±3.0 dyne/cm
Molar Volume: 187.4±3.0 cm3

Click to predict properties on the Chemicalize site


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