2-(4-Methoxyphenyl)thiazole-5-carbaldehyde supplier

Name
2-(4-METHOXYPHENYL)THIAZOLE-5-CARBALDEHYDE
EINECS
CAS No. 914348-82-6
Article Data2
CAS DataBase
Density 1.267 g/cm³
Solubility
Melting Point
Formula C₁₁H₉NO₂S
Boiling Point 387.586 °C at 760 mmHg
Molecular Weight 219.264
Flash Point 188.205 °C
Transport Information
Appearance
Safety 26
Risk Codes 36
Molecular Structure
Hazard Symbols
Synonyms 2-(4-Methoxyphenyl)thiazole-5-carbaldehyde;
PSA 67.43000
LogP 2.63120

2-(4-Methoxyphenyl)thiazole-5-carbaldehyde Specification

The 5-Thiazolecarboxaldehyde,2-(4-methoxyphenyl)-, with CAS registry number 914348-82-6, has the systematic name of 2-(4-methoxyphenyl)thiazole-5-carbaldehyde. And the chemical formula of this chemical is C₁₁H₉NO₂S.

Physical properties of 5-Thiazolecarboxaldehyde,2-(4-methoxyphenyl)-: (1)ACD/LogP: 1.74; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.743; (4)ACD/LogD (pH 7.4): 1.743; (5)ACD/BCF (pH 5.5): 12.445; (6)ACD/BCF (pH 7.4): 12.445; (7)ACD/KOC (pH 5.5): 211.547; (8)ACD/KOC (pH 7.4): 211.554; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 67.43 Å²; (13)Index of Refraction: 1.619; (14)Molar Refractivity: 60.752 cm³; (15)Molar Volume: 173.09 cm³; (16)Polarizability: 24.084×10^-24cm³; (17)Surface Tension: 49.738 dyne/cm; (18)Enthalpy of Vaporization: 63.667 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: COc1ccc(cc1)c2ncc(s2)C=O
(2)InChI: InChI=1/C11H9NO2S/c1-14-9-4-2-8(3-5-9)11-12-6-10(7-13)15-11/h2-7H,1H3
(3)InChIKey: DFJPGTVCVKDDEY-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C11H9NO2S/c1-14-9-4-2-8(3-5-9)11-12-6-10(7-13)15-11/h2-7H,1H3
(5)Std. InChIKey: DFJPGTVCVKDDEY-UHFFFAOYSA-N

Product Name

2-(4-METHOXYPHENYL)THIAZOLE-5-CARBALDEHYDE

2-(4-Methoxyphenyl)thiazole-5-carbaldehyde Specification

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