Thieno[3,2-c]pyridin-4(5H)-one supplier

Name
4-HYDROXYTHIENO[3,2-C]PYRIDINE
EINECS
CAS No. 27685-92-3
Article Data14
CAS DataBase
Density 1.355 g/cm³
Solubility
Melting Point 212 °C
Formula C₇H₅NOS
Boiling Point 406.041 °C at 760 mmHg
Molecular Weight 151.189
Flash Point 199.367 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms NSC 149764;4-Hydroxythieno[3,2-c]pyridine;4-Oxo-4,5-dihydrothieno[3,2-c]pyridine;5H-Thieno[3,2-c]pyridin-4-one;Oxodihydrothienopyridine;
PSA 61.10000
LogP 1.58960

Thieno[3,2-c]pyridin-4(5H)-one Specification

The Thieno[3,2-c]pyridin-4-ol, with the CAS registry number 27685-92-3, is also known as 5H-Thieno[3,2-c]pyridin-4-one. This chemical's molecular formula is C₇H₅NOS and molecular weight is 151.19. What's more, its IUPAC name is 5H-thieno[3,2-c]pyridin-4-one.

Physical properties of Thieno[3,2-c]pyridin-4-ol are: (1)ACD/LogP: 1.92; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.923; (4)ACD/BCF (pH 5.5): 17.045; (5)ACD/BCF (pH 7.4): 17.044; (6)ACD/KOC (pH 5.5): 264.965; (7)ACD/KOC (pH 7.4): 264.962; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 0; (11)Polar Surface Area: 57.34 Å²; (12)Index of Refraction: 1.634; (13)Molar Refractivity: 39.894 cm³; (14)Molar Volume: 111.566 cm³; (15)Surface Tension: 51.19 dyne/cm; (16)Density: 1.355 g/cm³; (17)Flash Point: 199.367 °C; (18)Enthalpy of Vaporization: 65.772 kJ/mol; (19)Boiling Point: 406.041 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CNC(=O)C2=C1SC=C2
(2)InChI: InChI=1S/C7H5NOS/c9-7-5-2-4-10-6(5)1-3-8-7/h1-4H,(H,8,9)
(3)InChIKey: DUPNPBCUJHMSFZ-UHFFFAOYSA-N

Product Name

4-HYDROXYTHIENO[3,2-C]PYRIDINE

Thieno[3,2-c]pyridin-4(5H)-one Specification

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