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2-Methylthieno[3,2-c]pyridin-4(5h)-one

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Name

2-Methylthieno[3,2-c]pyridin-4(5h)-one

EINECS N/A
CAS No. 59207-23-7 Density 1.292 g/cm3
PSA 61.10000 LogP 1.89800
Solubility N/A Melting Point N/A
Formula C8H7NOS Boiling Point 415.8 °C at 760 mmHg
Molecular Weight 165.216 Flash Point 205.3 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 59207-23-7 (2-methylthieno[3,2-c]pyridin-4(5H)-one) Hazard Symbols N/A
Synonyms

AKOS000266290;

Article Data 9

2-Methylthieno[3,2-c]pyridin-4(5h)-one Specification

The 2-Methylthieno[3,2-c]pyridin-4(5h)-one, with the CAS registry number 59207-23-7, is also known as AKOS000266290. This chemical's molecular formula is C8H7NOS and molecular weight is 165.21228. Its IUPAC name is called 2-methyl-5H-thieno[3,2-c]pyridin-4-one.

Physical properties of 2-Methylthieno[3,2-c]pyridin-4(5h)-one: (1)ACD/LogP: 1.41; (2)ACD/LogD (pH 5.5): 1.41; (3)ACD/LogD (pH 7.4): 1.41; (4)ACD/BCF (pH 5.5): 6.94; (5)ACD/BCF (pH 7.4): 6.94; (6)ACD/KOC (pH 5.5): 139.31; (7)ACD/KOC (pH 7.4): 139.31; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)Index of Refraction: 1.616; (11)Molar Refractivity: 44.71 cm3; (12)Molar Volume: 127.8 cm3; (13)Surface Tension: 48.1 dyne/cm; (14)Density: 1.292 g/cm3; (15)Flash Point: 205.3 °C; (16)Enthalpy of Vaporization: 66.9 kJ/mol; (17)Boiling Point: 415.8 °C at 760 mmHg; (18)Vapour Pressure: 4.01E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=CC2=C(S1)C=CNC2=O
(2)InChI: InChI=1S/C8H7NOS/c1-5-4-6-7(11-5)2-3-9-8(6)10/h2-4H,1H3,(H,9,10)
(3)InChIKey: CZZYGMSEVJJFRE-UHFFFAOYSA-N

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