CAS No.13838-78-3,5-Methyl-1,3-thiazole-2-carboxaldehyde Suppliers

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Basic Information

Molecular Structure:
CAS No.:	13838-78-3
Name:	5-Methyl-1,3-thiazole-2-carboxaldehyde
Article Data:	10
Cas Database

Formula:	C₅H₅NOS
Molecular Weight:	127.1643
Synonyms:	5-Methyl-1,3-thiazole-2-carboxaldehyde;5-Methylthiazole-2-carboxaldehyde;
Density:	1.27 g/cm³
Boiling Point:	236.008 °C at 760 mmHg
Flash Point:	96.535 °C
PSA:	58.20000
LogP:	1.26400

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Specification

The 2-Thiazolecarboxaldehyde,5-methyl- is an organic compound with the formula C₅H₅NOS. The IUPAC name of this chemical is 5-methyl-1,3-thiazole-2-carbaldehyde. With the CAS registry number 13838-78-3, it is also named as 5-(Tributylstannyl)thiazole-2-carbaldehyde. The product's categories are Aldehydes; Thiazoles, Isothiazoles & Benzothiazoles; Thiazoles, Isothiazoles & Benzothiazoles.

Physical properties about 2-Thiazolecarboxaldehyde,5-methyl- are: (1)ACD/LogP: 0.90; (2)ACD/LogD (pH 5.5): 0.901; (3)ACD/LogD (pH 7.4): 0.901; (4)ACD/BCF (pH 5.5): 2.852; (5)ACD/BCF (pH 7.4): 2.852; (6)ACD/KOC (pH 5.5): 73.688; (7)ACD/KOC (pH 7.4): 73.689; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 58.2 Å²; (11)Index of Refraction: 1.601; (12)Molar Refractivity: 34.306 cm³; (13)Molar Volume: 100.078 cm³; (14)Polarizability: 13.6×10^-24cm³; (15)Surface Tension: 50.879 dyne/cm; (16)Density: 1.271 g/cm³; (17)Flash Point: 96.535 °C; (18)Enthalpy of Vaporization: 45.361 kJ/mol; (19)Boiling Point: 236.008 °C at 760 mmHg; (20)Vapour Pressure: 0.074 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1cnc(s1)C=O
(2)InChI: InChI=1/C5H5NOS/c1-4-2-6-5(3-7)8-4/h2-3H,1H3
(3)InChIKey: UUIAJFQYWAFZEO-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C5H5NOS/c1-4-2-6-5(3-7)8-4/h2-3H,1H3
(5)Std. InChIKey: UUIAJFQYWAFZEO-UHFFFAOYSA-N