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2-Furanpropanoic acid,5-(2-thienyl)-

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Name

2-Furanpropanoic acid,5-(2-thienyl)-

EINECS N/A
CAS No. 24090-38-8 Density 1.3 g/cm3
PSA 78.68000 LogP 3.02530
Solubility N/A Melting Point N/A
Formula C11H10O3S Boiling Point 365.7 °C at 760 mmHg
Molecular Weight 222.26 Flash Point 174.9 °C
Transport Information N/A Appearance N/A
Safety Risk Codes 22
Molecular Structure Molecular Structure of 24090-38-8 (3-(5-THIOPHEN-2-YL-FURAN-2-YL)-PROPIONIC ACID) Hazard Symbols IrritantXi
Synonyms

2-Furanpropionicacid, 5-(2-thienyl)- (8CI);AKOS BB-9822;3-(5-Thiophen-2-yl-furan-2-yl)-propionic acid;

 

2-Furanpropanoic acid,5-(2-thienyl)- Specification

The CAS register number of 2-Furanpropanoic acid,5-(2-thienyl)- is 24090-38-8. The IUPAC name about this chemical is 3-(5-thiophen-2-ylfuran-2-yl)propanoic acid. The molecular formula about this chemical is C11H10O3S and the molecular weight is 222.26. This chemical may cause inflammation to the skin or other mucous membranes.

Physical properties about 2-Furanpropanoic acid,5-(2-thienyl)- are: (1)ACD/LogP: 2.59; (2)ACD/BCF (pH 5.5): 5.08; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 56.61; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 3; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 4; (9)Polar Surface Area: 67.68 Å2; (10)Index of Refraction: 1.584; (11)Molar Refractivity: 57.27 cm3; (12)Molar Volume: 170.9 cm3; (13)Polarizability: 22.7x10-24cm3; (14)Surface Tension: 50.6 dyne/cm; (15)Density: 1.3 g/cm3; (16)Flash Point: 174.9 °C; (17)Enthalpy of Vaporization: 64.57 kJ/mol; (18)Boiling Point: 365.7 °C at 760 mmHg; (19)Vapour Pressure: 5.45E-06 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)CCc2oc(c1sccc1)cc2
(2)InChI: InChI=1/C11H10O3S/c12-11(13)6-4-8-3-5-9(14-8)10-2-1-7-15-10/h1-3,5,7H,4,6H2,(H,12,13)
(3)InChIKey: ADIPPCCQUCTDJD-UHFFFAOYAU
(4)Std. InChI: InChI=1S/C11H10O3S/c12-11(13)6-4-8-3-5-9(14-8)10-2-1-7-15-10/h1-3,5,7H,4,6H2,(H,12,13)
(5)Std. InChIKey: ADIPPCCQUCTDJD-UHFFFAOYSA-N

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