4-Phenylthiophene-2-carbaldehyde supplier

Name
4-PHENYL-2-THIOPHENECARBOXALDEHYDE 96
EINECS
CAS No. 26170-87-6
Article Data14
CAS DataBase
Density 1.207 g/cm³
Solubility
Melting Point 67-71 °C(lit.)
Formula C₁₁H₈OS
Boiling Point 312.4 °C at 760 mmHg
Molecular Weight 188.25
Flash Point 118.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Phenylthiophene-2-carboxaldehyde;4-Phenylthiophene-2-carboxaldehyde,4-Phenyl-2-thiophenecarboxaldehyde;
PSA 45.31000
LogP 3.22760

4-Phenylthiophene-2-carbaldehyde Specification

This chemical has the systematic name 4-Phenylthiophene-2-carbaldehyde, and it's also named as 2-thiophenecarboxaldehyde, 4-phenyl-. Its molecular formula is C₁₁H₈OS and its molecular weight is 188.24562. Additionally, the CAS registry number of this chemical is 26170-87-6.

Other characteristics of the 4-Phenylthiophene-2-carbaldehyde can be summarised as followings: (1)ACD/LogP: 3.06; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.06; (4)ACD/LogD (pH 7.4): 3.06; (5)ACD/BCF (pH 5.5): 124.05; (6)ACD/BCF (pH 7.4): 124.05; (7)ACD/KOC (pH 5.5): 1097.02; (8)ACD/KOC (pH 7.4): 1097.02; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 45.31 Å²; (13)Index of Refraction: 1.637; (14)Molar Refractivity: 55.98 cm³; (15)Molar Volume: 155.8 cm3; (16)Polarizability: 22.19×10^-24cm³; (17)Surface Tension: 47.3 dyne/cm; (18)Density: 1.207 g/cm³; (19)Flash Point: 118.1 °C; (20)Enthalpy of Vaporization: 55.34 kJ/mol; (21)Boiling Point: 312.4 °C at 760 mmHg; (22)Vapour Pressure: 0.000531 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=Cc2scc(c1ccccc1)c2
2.InChI: InChI=1/C11H8OS/c12-7-11-6-10(8-13-11)9-4-2-1-3-5-9/h1-8H
3.InChIKey: TXIFKGWOQSVIMZ-UHFFFAOYAO

Product Name

4-PHENYL-2-THIOPHENECARBOXALDEHYDE 96

4-Phenylthiophene-2-carbaldehyde Specification

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