Benzaldehyde,4-(3-thienyl)- supplier

Name
4-(3-THIENYL)BENZALDEHYDE
EINECS
CAS No. 157730-74-0
Article Data17
CAS DataBase
Density 1.207 g/cm³
Solubility
Melting Point 98-100 °C
Formula C₁₁H₈OS
Boiling Point 298.1 °C at 760 mmHg
Molecular Weight 188.25
Flash Point 113.4 °C
Transport Information
Appearance
Safety
Risk Codes Xi:Irritant;
Molecular Structure
Hazard Symbols Xi
Synonyms 4-(3-Thienyl)benzaldehyde;
PSA 45.31000
LogP 3.22760

Benzaldehyde,4-(3-thienyl)- Specification

The Benzaldehyde,4-(3-thienyl)- is an organic compound with the formula C₁₁H₈OS. The systematic name of this chemical is 4-Thiophen-3-ylbenzaldehyde. With the CAS registry number 157730-74-0, it is also named as 4-(3-Thienyl)benzenecarbaldehyde. Besides, its molecular weight is 188.25.

Physical properties about Benzaldehyde,4-(3-thienyl)- are: (1)ACD/LogP: 3.51; (2)ACD/LogD (pH 5.5): 3.51; (3)ACD/LogD (pH 7.4): 3.51; (4)ACD/BCF (pH 5.5): 271.7; (5)ACD/BCF (pH 7.4): 271.7; (6)ACD/KOC (pH 5.5): 1922.76; (7)ACD/KOC (pH 7.4): 1922.76; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 45.31 Å²; (11)Index of Refraction: 1.637; (12)Molar Refractivity: 55.98 cm³; (13)Molar Volume: 155.8 cm³; (14)Polarizability: 22.19×10^-24 cm³; (15)Surface Tension: 47.3 dyne/cm; (16)Density: 1.207 g/cm³; (17)Flash Point: 113.4 °C; (18)Enthalpy of Vaporization: 53.8 kJ/mol; (19)Boiling Point: 298.1 °C at 760 mmHg; (20)Vapour Pressure: 0.0013 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C11H8OS/c12-7-9-1-3-10(4-2-9)11-5-6-13-8-11/h1-8H
(2)InChIKey: MGPZYZLJJSEFLU-UHFFFAOYAR
(3)Std. InChI: InChI=1S/C11H8OS/c12-7-9-1-3-10(4-2-9)11-5-6-13-8-11/h1-8H
(4)Std. InChIKey: MGPZYZLJJSEFLU-UHFFFAOYSA-N

Product Name

4-(3-THIENYL)BENZALDEHYDE

Benzaldehyde,4-(3-thienyl)- Specification

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