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89336-46-9

Basic Information
CAS No.: 89336-46-9
Name: 4-Thiazoleacetic acid,2-[[(1,1-dimethylethoxy)carbonyl]amino]-
Article Data: 10
Cas Database
Molecular Structure:
Molecular Structure of 89336-46-9 (4-Thiazoleacetic acid,2-[[(1,1-dimethylethoxy)carbonyl]amino]-)
Formula: C10H14N2O4S
Molecular Weight: 258.298
Synonyms: {2-[(Tert-butoxycarbonyl)amino]-1,3-thiazol-4-yl}acetic acid;Boc-2-amino-4-thiazole acetic acid;
EINECS: N/A
Density: 1.37 g/cm3
Melting Point: 168 °C
Boiling Point: N/A
Flash Point: N/A
Solubility: N/A
Appearance: N/A
Hazard Symbols: N/A
Risk Codes: N/A
Safety:
Transport Information: N/A
PSA: 116.76000
LogP: 2.19020
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  • 2-(Pyrrolidin-1-yl)-1,3-thiazole

  • Casno:

    89336-46-9

    2-(Pyrrolidin-1-yl)-1,3-thiazole

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    FOB Price:  USD $ 0.0-0.0/

    2-(Pyrrolidin-1-yl)-1,3-thiazoleAppearance:Off white to slight yellow solid Storage:Stored in shaded, cool and dry places Package:1L 5L 10L 25L bottle Application:pharma intermediate Transportation:Handle with cares to avoid damaging the packages. Pr

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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