CAS No.73150-67-1,2-(2-Aminothiazol-4-yl)glyoxylic acid Suppliers

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Basic Information

Molecular Structure:
CAS No.:	73150-67-1
Name:	2-(2-Aminothiazol-4-yl)glyoxylic acid
Article Data:	3

Formula:	C₅H₄N₂O₃S
Molecular Weight:	172.164
Synonyms:	(2-Amino-4-thiazolyl)glyoxylicacid;2-(2-Aminothiazol-4-yl)glyoxylic acid;2-Amino-4-thiazoleglyoxylic acid;2-Amino-a-oxo-4-thiazoleacetic acid;
EINECS:	277-301-0
Density:	1.711 g/cm³
Boiling Point:	395.7 ºC at 760 mmHg
Flash Point:	193.1 ºC
PSA:	121.52000
LogP:	0.57380

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Specification

The 2-(2-Aminothiazol-4-yl)glyoxylic acid, with the CAS registry number 73150-67-1, has the IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-2-oxoacetic acid. As to its usage, it is usually used as the intermediates of cephalosporins drugs, with the product categories including organic acids.

The physical properties of this chemical are as follows: (1)ACD/LogP: -0.57; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 5; (8)#H bond donors: 3; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 121.52; (11)Index of Refraction: 1.693; (12)Molar Refractivity: 38.557 cm³; (13)Molar Volume: 100.573 cm³; (14)Polarizability: 15.285×10^-24 cm³; (15)Surface Tension: 99.187 dyne/cm; (16)Density: 1.712 g/cm³; (17)Flash Point: 193.137 °C; (18)Enthalpy of Vaporization: 68.123 kJ/mol; (19)Boiling Point: 395.74 °C at 760 mmHg; (20)Exact Mass: 171.994263; (21)MonoIsotopic Mass: 171.994263; (22)Topological Polar Surface Area: 122; (23)Heavy Atom Count: 11; (24)Complexity: 196.

Additionally, you could obtain the molecular structure by converting the following datas:
(1)Canonical SMILES: C1=C(N=C(S1)N)C(=O)C(=O)O
(2)InChI: InChI=1S/C5H4N2O3S/c6-5-7-2(1-11-5)3(8)4(9)10/h1H,(H2,6,7)(H,9,10)
(3)InChIKey: VMASTYPGLHRVNL-UHFFFAOYSA-N