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CAS No.: | 66659-20-9 |
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Name: | 2-(2-Aminothiazol-4-yl) acetic acid hydrochloride |
Molecular Structure: | |
Formula: | C5H6N2O2S.HCl |
Molecular Weight: | 194.642 |
Synonyms: | 4-Thiazoleaceticacid, 2-amino-, monohydrochloride (9CI);(2-Amino-1,3-thiazol-4-yl)acetic acid hydrochloride; |
EINECS: | 1308068-626-2 |
Melting Point: | 152 °C |
Boiling Point: | 409.9 °C at 760 mmHg |
Flash Point: | 201.7 °C |
PSA: | 104.45000 |
LogP: | 1.73560 |
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The 4-Thiazoleacetic acid,2-amino-, hydrochloride (1:1), with the CAS registry number 66659-20-9, is also known as 4-Thiazoleaceticacid, 2-amino-, monohydrochloride. It belongs to the product categories of Organic acids; Intermediate of cefotiam. This chemical's molecular formula is C5H6N2O2S·HCl and molecular weight is 194.64. What's more, its systematic name is (2-amino-1,3-thiazol-4-yl)acetic acid hydrochloride. It should be sealed and stored in a cool and dry place. Moreover, it should be protected from oxidants.
Physical properties of 4-Thiazoleacetic acid,2-amino-, hydrochloride (1:1) are: (1)# of Rule of 5 Violations: 0; (2)#H bond acceptors: 4; (3)#H bond donors: 3; (4)#Freely Rotating Bonds: 2; (5)Polar Surface Area: 104.45 Å2; (6)Flash Point: 201.7 °C; (7)Enthalpy of Vaporization: 69.81 kJ/mol; (8)Boiling Point: 409.9 °C at 760 mmHg; (9)Vapour Pressure: 1.88E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl.O=C(O)Cc1csc(N)n1
(2)Std. InChI: InChI=1S/C5H6N2O2S.ClH/c6-5-7-3(2-10-5)1-4(8)9;/h2H,1H2,(H2,6,7)(H,8,9);1H
(3)Std. InChIKey: ZEWJJZKVQOMYKJ-UHFFFAOYSA-N