4-Thiazolecarboxylicacid,2-amino-5-methyl-(9CI) supplier

Name
4-Thiazolecarboxylicacid,2-amino-5-methyl-(9CI)
EINECS
CAS No. 688064-14-4
Density 1.532 g/cm³
Solubility
Melting Point
Formula C₅H₆N₂O₂S
Boiling Point 400.609 °C at 760 mmHg
Molecular Weight 158.17
Flash Point 196.082 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Amino-5-methylthiazole-4-carboxylic acid;2-Amino-5-methyl-1,3-thiazole-4-carboxylic acid;
PSA 104.45000
LogP 1.31310

4-Thiazolecarboxylicacid,2-amino-5-methyl-(9CI) Specification

The 4-Thiazolecarboxylicacid,2-amino-5-methyl-(9CI), with the CAS registry number 688064-14-4, is also known as 2-Amino-5-methylthiazole-4-carboxylic acid. It belongs to the product categories of Carboxylicacid; Glycinescaffold. This chemical's molecular formula is C₅H₆N₂O₂S and molecular weight is 158.17. What's more, its systematic name is 2-Amino-5-methyl-1,3-thiazole-4-carboxylic acid.

Physical properties of 4-Thiazolecarboxylicacid,2-amino-5-methyl-(9CI) are: (1)ACD/LogP: 0.47; (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: 4; (8)#H bond donors: 3; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 104.45 Å²; (11)Index of Refraction: 1.674; (12)Molar Refractivity: 38.72 cm³; (13)Molar Volume: 103.222 cm³; (14)Polarizability: 15.35×10^-24 cm³; (15)Surface Tension: 81.547 dyne/cm; (16)Density: 1.532 g/cm³; (17)Flash Point: 196.082 °C; (18)Enthalpy of Vaporization: 68.704 kJ/mol; (19)Boiling Point: 400.609 °C at 760 mmHg; (20)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1c(nc(s1)N)C(=O)O
(2)InChI: InChI=1/C5H6N2O2S/c1-2-3(4(8)9)7-5(6)10-2/h1H3,(H2,6,7)(H,8,9)
(3)InChIKey: BAANOAVDEBKXEY-UHFFFAOYAR

Product Name

4-Thiazolecarboxylicacid,2-amino-5-methyl-(9CI)

4-Thiazolecarboxylicacid,2-amino-5-methyl-(9CI) Specification

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