4H-Thieno[3,2-b]azepine,5,6,7,8-tetrahydro- supplier

Name
5,6,7,8-TETRAHYDRO-4H-THIENO[3,2-B]AZEPINE
EINECS
CAS No. 180340-57-2
Article Data9
CAS DataBase
Density 1.098 g/cm³
Solubility
Melting Point
Formula C₈H₁₁NS
Boiling Point 279.215 °C at 760 mmHg
Molecular Weight 153.248
Flash Point 122.665 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4H,5H,6H,7H,8H-Thieno[3,2-b]azepine;
PSA 40.27000
LogP 2.63430

4H-Thieno[3,2-b]azepine,5,6,7,8-tetrahydro- Specification

The 4H-Thieno[3,2-b]azepine,5,6,7,8-tetrahydro-, with the CAS registry number of 180340-57-2, is also known as 4H,5H,6H,7H,8H-Thieno[3,2-b]azepine. Its molecular formula is C₈H₁₁NS and molecular weight is 153.24. What's more, its systematic name is 5,6,7,8-Tetrahydro-4H-thieno[3,2-b]azepine.

Physical properties about the 4H-Thieno[3,2-b]azepine,5,6,7,8-tetrahydro- are: (1)ACD/LogP: 2.38; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 0; (6)Polar Surface Area: 40.27 Å²; (7)Index of Refraction: 1.555; (8)Molar Refractivity: 44.771 cm³; (9)Molar Volume: 139.513 cm³; (10)Surface Tension: 39.388 dyne/cm; (11)Density: 1.098 g/cm³; (12)Flash Point: 122.665 °C; (13)Enthalpy of Vaporization: 51.788 kJ/mol; (14)Boiling Point: 279.215 °C at 760 mmHg; (15)Vapour Pressure: 0.004 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: s1ccc2NCCCCc12
(2) InChI: InChI=1/C8H11NS/c1-2-5-9-7-4-6-10-8(7)3-1/h4,6,9H,1-3,5H2
(3) InChIKey: BXQBADSCRTXJPX-UHFFFAOYAP

Product Name

5,6,7,8-TETRAHYDRO-4H-THIENO[3,2-B]AZEPINE

4H-Thieno[3,2-b]azepine,5,6,7,8-tetrahydro- Specification

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