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