ChemSpider 2D Image | 4-Chloro-2-(3-thienyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine | C14H11ClN2S2

4-Chloro-2-(3-thienyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine

  • Molecular FormulaC14H11ClN2S2
  • Average mass306.833 Da
  • Monoisotopic mass306.005219 Da
  • ChemSpider ID25999903

More details:

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

[1]Benzothieno[2,3-d]pyrimidine, 4-chloro-5,6,7,8-tetrahydro-2-(3-thienyl)- [ACD/Index Name]
1155055-78-9 [RN]
3-chloro-5-(thiophen-3-yl)-8-thia-4,6-diazatricyclo[7.4.0.0,2,7]trideca-1(9),2,4,6-tetraene
4-Chlor-2-(3-thienyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin [German] [ACD/IUPAC Name]
4-Chloro-2-(3-thienyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine [ACD/IUPAC Name]
4-Chloro-2-(3-thiényl)-5,6,7,8-tétrahydro[1]benzothiéno[2,3-d]pyrimidine [French] [ACD/IUPAC Name]
3-CHLORO-5-(THIOPHEN-3-YL)-8-THIA-4,6-DIAZATRICYCLO[7.4.0.0(2,7)]TRIDECA-1(9),2,4,6-TETRAENE
3-chloro-5-(thiophen-3-yl)-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraene
3-chloro-5-(thiophen-3-yl)-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraene
MFCD12589396 [MDL number]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.711
Molar Refractivity: 83.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 6.12
ACD/LogD (pH 5.5): 5.05
ACD/BCF (pH 5.5): 4069.66
ACD/KOC (pH 5.5): 13344.81
ACD/LogD (pH 7.4): 5.05
ACD/BCF (pH 7.4): 4069.77
ACD/KOC (pH 7.4): 13345.16
Polar Surface Area: 82 Å2
Polarizability: 33.0±0.5 10-24cm3
Surface Tension: 63.4±3.0 dyne/cm
Molar Volume: 213.0±3.0 cm3

Click to predict properties on the Chemicalize site


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