N-Boc-2-amino-4-thiazolacetic acid supplier

Name
(2-TERT-BUTOXYCARBONYLAMINO-THIAZOL-4-YL)-ACETIC ACID
EINECS
CAS No. 89336-46-9
Article Data10
CAS DataBase
Density 1.37 g/cm³
Solubility
Melting Point 168 °C
Formula C₁₀H₁₄N₂O₄S
Boiling Point
Molecular Weight 258.298
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms {2-[(Tert-butoxycarbonyl)amino]-1,3-thiazol-4-yl}acetic acid;Boc-2-amino-4-thiazole acetic acid;
PSA 116.76000
LogP 2.19020

N-Boc-2-amino-4-thiazolacetic acid Specification

The 4-Thiazoleacetic acid,2-[[(1,1-dimethylethoxy)carbonyl]amino]- with CAS registry number of 89336-46-9 is also known as N-Boc-2-amino-4-thiazolacetic acid. The systematic name is {2-[(Tert-butoxycarbonyl)amino]-1,3-thiazol-4-yl}acetic acid. In addition, the formula is C₁₀H₁₄N₂O₄S and the molecular weight is 258.29.

Physical properties about 4-Thiazoleacetic acid,2-[[(1,1-dimethylethoxy)carbonyl]amino]- are: (1)ACD/LogP: 1.30; (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: 6; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 4; (9)Index of Refraction: 1.591; (10)Molar Refractivity: 63.724 cm³; (11)Molar Volume: 188.593 cm³; (12)Surface Tension: 58.165 dyne/cm; (13)Density: 1.37 g/cm³.

You can still convert the following datas into molecular structure:
1. SMILES: OC(=O)Cc1csc(NC(=O)OC(C)(C)C)n1
2. InChI: InChI=1/C10H14N2O4S/c1-10(2,3)16-9(15)12-8-11-6(5-17-8)4-7(13)14/h5H,4H2,1-3H3,(H,13,14)(H,11,12,15)
3. InChIKey: LNUBPLFRRHJPLI-UHFFFAOYAH
4. Std. InChI: InChI=1S/C10H14N2O4S/c1-10(2,3)16-9(15)12-8-11-6(5-17-8)4-7(13)14/h5H,4H2,1-3H3,(H,13,14)(H,11,12,15)
5. Std. InChIKey: LNUBPLFRRHJPLI-UHFFFAOYSA-N

Product Name

(2-TERT-BUTOXYCARBONYLAMINO-THIAZOL-4-YL)-ACETIC ACID

N-Boc-2-amino-4-thiazolacetic acid Specification

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