Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
5-(4-chlorophenyl)thiophene-2-carbaldehyde |
EINECS | N/A |
CAS No. | 38401-71-7 | Density | 1.327 g/cm3 |
PSA | 45.31000 | LogP | 3.88100 |
Solubility | N/A | Melting Point |
85-86°C |
Formula | C11H7ClOS | Boiling Point | 367.4 °C at 760 mmHg |
Molecular Weight | 222.695 | Flash Point | 176 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26-36/37 | Risk Codes | 22-36-43 |
Molecular Structure | Hazard Symbols | Xi,Xn | |
Synonyms |
5-(4-Chlorophenyl)-2-thiophenecarboxaldehyde;5-(p-Chlorophenyl)-2-thiophenecarboxaldehyde; |
Article Data | 10 |
The 2-Thiophenecarboxaldehyde,5-(4-chlorophenyl)- is an organic compound with the formula C11H7ClOS. The IUPAC name of this chemical is 5-(4-Chlorophenyl)thiophene-2-carbaldehyde. With the CAS registry number 38401-71-7, it is also named as 5-(4-Chlorophenyl)-2-thiophenecarbaldehyde. Besides, its molecular weight is 195.2813.
The physical properties of 2-Thiophenecarboxaldehyde,5-(4-chlorophenyl)- are: (1)ACD/LogP: 3.75; (2)ACD/LogD (pH 5.5): 3.75; (3)ACD/LogD (pH 7.4): 3.75; (4)ACD/BCF (pH 5.5): 419.96; (5)ACD/BCF (pH 7.4): 419.96; (6)ACD/KOC (pH 5.5): 2626; (7)ACD/KOC (pH 7.4): 2626; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 45.31 Å2; (11)Index of Refraction: 1.645; (12)Molar Refractivity: 60.87 cm3; (13)Molar Volume: 167.8 cm3; (14)Polarizability: 24.13×10-24 cm3; (15)Surface Tension: 49.3 dyne/cm; (16)Density: 1.327 g/cm3; (17)Flash Point: 176 °C; (18)Enthalpy of Vaporization: 61.39 kJ/mol; (19)Boiling Point: 367.4 °C at 760 mmHg; (20)Vapour Pressure: 1.37E-05 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc2sc(c1ccc(Cl)cc1)cc2
(2)InChI: InChI=1/C11H7ClOS/c12-9-3-1-8(2-4-9)11-6-5-10(7-13)14-11/h1-7H
(3)InChIKey: JFAKPLYPDADDKE-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C11H7ClOS/c12-9-3-1-8(2-4-9)11-6-5-10(7-13)14-11/h1-7H
(5)Std. InChIKey: JFAKPLYPDADDKE-UHFFFAOYSA-N