Thiazol-5-ylmethylamine hydrochloride supplier

Name
C-THIAZOL-4-YL-METHYLAMINE HYDROCHLORIDE
EINECS 604-604-1
CAS No. 131052-46-5
Article Data3
CAS DataBase
Density
Solubility
Melting Point
Formula C₄H₇ClN₂S
Boiling Point 255.1 °C at 760 mmHg
Molecular Weight 150.632
Flash Point 108.1 °C
Transport Information
Appearance
Safety 45
Risk Codes 25
Molecular Structure
Hazard Symbols T
Synonyms 5-Thiazolemethanamine,monohydrochloride (9CI);
PSA 67.15000
LogP 2.10410

Thiazol-5-ylmethylamine hydrochloride Specification

The 5-Thiazolemethanamine,hydrochloride (1:1), with CAS registry number 131052-46-5, has the systematic name of 5-(aminomethyl)-1,3-thiazol-3-ium chloride. Besides this, it is also called C-Thiazol-4-yl-methylamine hydrochloride. And the chemical formula of this chemical is C₄H₇ClN₂S.

Physical properties of 5-Thiazolemethanamine,hydrochloride (1:1): (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 2; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 68.4 Å²; (10)Flash Point: 108.1 °C; (11)Enthalpy of Vaporization: 50.25 kJ/mol; (12)Boiling Point: 255.1 °C at 760 mmHg; (13)Vapour Pressure: 0.0131 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: [Cl-].NCc1c[nH+]cs1
(2)InChI: InChI=1/C4H6N2S.ClH/c5-1-4-2-6-3-7-4;/h2-3H,1,5H2;1H
(3)InChIKey: WZJFBMHEYMPACF-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C4H6N2S.ClH/c5-1-4-2-6-3-7-4;/h2-3H,1,5H2;1H
(5)Std. InChIKey: WZJFBMHEYMPACF-UHFFFAOYSA-N

Product Name

C-THIAZOL-4-YL-METHYLAMINE HYDROCHLORIDE

Thiazol-5-ylmethylamine hydrochloride Specification

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