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N-(4-methyl-1,3-thiazol-2-yl)acetamide

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Name

N-(4-methyl-1,3-thiazol-2-yl)acetamide

EINECS N/A
CAS No. 7336-51-8 Density 1.285 g/cm3
PSA 70.23000 LogP 1.48290
Solubility N/A Melting Point 134-136 °C(lit.)
Formula C6H8N2OS Boiling Point N/A
Molecular Weight 156.208 Flash Point N/A
Transport Information N/A Appearance N/A
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 7336-51-8 (2-ACETAMIDO-4-METHYLTHIAZOLE) Hazard Symbols IrritantXi
Synonyms

2-Acetamido-4-methylthiazole;acetamide, N-(4-methyl-2-thiazolyl)-;N1-(4-methyl-1,3-thiazol-2-yl)acetamide;

Article Data 23

N-(4-methyl-1,3-thiazol-2-yl)acetamide Specification

The N-(4-methyl-1,3-thiazol-2-yl)acetamide, with the CAS registry number 7336-51-8, has the systematic name of N-(4-methyl-1,3-thiazol-2-yl)acetamide. It belongs to the following product categories: Heterocyclic Compounds; Building Blocks; Heterocyclic Building Blocks; Thiazoles. And the molecular formula of the chemical is C6H8N2OS.

The characteristics of N-(4-methyl-1,3-thiazol-2-yl)acetamide are as followings: (1)ACD/LogP: 1.22; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.22; (4)ACD/LogD (pH 7.4): 1.22; (5)ACD/BCF (pH 5.5): 4.94; (6)ACD/BCF (pH 7.4): 4.96; (7)ACD/KOC (pH 5.5): 109.02; (8)ACD/KOC (pH 7.4): 109.28; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 61.44 Å2; (13)Index of Refraction: 1.604; (14)Molar Refractivity: 41.82 cm3; (15)Molar Volume: 121.4 cm3; (16)Polarizability: 16.58×10-24cm3; (17)Surface Tension: 51.8 dyne/cm; (18)Density: 1.285 g/cm3.    

You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(Nc1nc(cs1)C)C
(2)InChI: InChI=1/C6H8N2OS/c1-4-3-10-6(7-4)8-5(2)9/h3H,1-2H3,(H,7,8,9)
(3)InChIKey: DPDJXTANWGNJOE-UHFFFAOYAA

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