CAS No.38401-71-7,5-(4-chlorophenyl)thiophene-2-carbaldehyde Suppliers

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Basic Information

Molecular Structure:
CAS No.:	38401-71-7
Name:	5-(4-chlorophenyl)thiophene-2-carbaldehyde
Article Data:	10

Formula:	C₁₁H₇ClOS
Molecular Weight:	222.695
Synonyms:	5-(4-Chlorophenyl)-2-thiophenecarboxaldehyde;5-(p-Chlorophenyl)-2-thiophenecarboxaldehyde;
Density:	1.327 g/cm³
Melting Point:	85-86°C
Boiling Point:	367.4 °C at 760 mmHg
Flash Point:	176 °C
Hazard Symbols:	Xi,Xn
Risk Codes:	22-36-43
Safety:	26-36/37
PSA:	45.31000
LogP:	3.88100

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Specification

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