5-Amino-3-methylisothiazole hydrochloride supplier

Name
5-AMINO-3-METHYLISOTHIAZOLE HYDROCHLORIDE
EINECS 257-997-2
CAS No. 52547-00-9
Density
Solubility
Melting Point 300 °C(lit.)
Formula C₄H₇ClN₂S
Boiling Point 120.7 °C at 760 mmHg
Molecular Weight 150.632
Flash Point 26.8 °C
Transport Information
Appearance yellow to red-brown to brown powder
Safety 22-24/25
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 5-Amino-3-methylisothiazolemonohydrochloride;5-Isothiazolamine,3-methyl-, monohydrochloride (9CI);
PSA 67.15000
LogP 2.41690

5-Amino-3-methylisothiazole hydrochloride Specification

The 3-Methyl-5-isothiazolamine hydro-chloride, with the CAS registry number 52547-00-9, is also known as 5-Isothiazolamine, 3-methyl-, hydrochloride (1:1). Its molecular formula is C₄H₇ClN₂S and its systematic name is 3-methyl-1,2-thiazol-5-aminium chloride. Additionally, its product categories are Amines; Heterocyclic Compounds; Chemical Amines; Bases & Related Reagents; Heterocycles; Nucleotides; Sulfur & Selenium Compounds; Building Blocks; Heterocyclic Building Blocks; Thiazoles. However, this chemical should be kept cool and dry.

Other characteristics of the 3-Methyl-5-isothiazolamine hydro-chloride can be summarised as followings: (1)/LogP: -0.01; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.38; (4)ACD/LogD (pH 7.4): -1.09; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1.98; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 41.13 Å²; (13)Flash Point: 26.8 °C; (14)Enthalpy of Vaporization: 35.88 kJ/mol; (15)Boiling Point: 120.7 °C at 760 mmHg; (16)Vapour Pressure: 15 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: Do not breathe dust. Avoid contacting with skin and eyes.

You can still convert the following datas into molecular structure:
1.SMILES: [Cl-].n1sc(cc1C)[NH3+]
2.InChI: InChI=1/C4H6N2S.ClH/c1-3-2-4(5)7-6-3;/h2H,5H2,1H3;1H
3.InChIKey: ZRTGHKVPFXNDHE-UHFFFAOYAS

Product Name

5-AMINO-3-METHYLISOTHIAZOLE HYDROCHLORIDE

5-Amino-3-methylisothiazole hydrochloride Specification

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