Ethanone, 1-(4H-thieno[3,2-b]pyrrol-5-yl)- supplier

Name
1-(4H-THIENO[3,2-B]PYRROL-5-YL)ETHANONE
EINECS
CAS No. 60664-20-2
Article Data3
CAS DataBase
Density 1.344 g/cm³
Solubility
Melting Point
Formula C₈H₇NOS
Boiling Point 340.5 °C at 760 mmHg
Molecular Weight 165.2123
Flash Point 159.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-(4H-Thieno[3,2-b]pyrrol-5-yl)ethan-1-one;
PSA 61.10000
LogP 2.43200

Ethanone, 1-(4H-thieno[3,2-b]pyrrol-5-yl)- Specification

The CAS registry number of Ethanone, 1-(4H-thieno[3,2-b]pyrrol-5-yl)- is 60664-20-2. This chemical is also named as 1-(4H-Thieno[3,2-b]pyrrol-5-yl)ethan-1-one. In addition, its molecular formula is C₈H₇NOS and molecular weight is 165.2123. Its systematic name is called 1-(4H-thieno[3,2-b]pyrrol-5-yl)ethanone.

Physical properties about Ethanone, 1-(4H-thieno[3,2-b]pyrrol-5-yl)- are: (1)ACD/LogP: 2.52; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 1; (6)Index of Refraction: 1.689; (7)Molar Refractivity: 46.94 cm³; (8)Molar Volume: 122.8 cm³; (9)Surface Tension: 57.9 dyne/cm; (10)Density: 1.344 g/cm³; (11)Flash Point: 159.7 °C; (12)Enthalpy of Vaporization: 58.4 kJ/mol; (13)Boiling Point: 340.5 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c2cc1sccc1n2)C
(2)InChI: InChI=1/C8H7NOS/c1-5(10)7-4-8-6(9-7)2-3-11-8/h2-4,9H,1H3
(3)InChIKey: WLDJWDMZKFKABJ-UHFFFAOYAD

Product Name

1-(4H-THIENO[3,2-B]PYRROL-5-YL)ETHANONE

Ethanone, 1-(4H-thieno[3,2-b]pyrrol-5-yl)- Specification

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