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2-(2-tert-Butoxycarbonylaminothiazol-4-yl)-2-pentenedioic acid

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Name

2-(2-tert-Butoxycarbonylaminothiazol-4-yl)-2-pentenedioic acid

EINECS N/A
CAS No. 103054-22-4 Density 1.441
PSA 154.06000 LogP 2.50580
Solubility N/A Melting Point N/A
Formula C13H16 N2 O6 S Boiling Point N/A
Molecular Weight 328.34 Flash Point N/A
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 103054-22-4 (2-(2-tert-Butoxycarbonylaminothiazol-4-yl)-2-pentenedioic acid) Hazard Symbols N/A
Synonyms

2-[2-[[(1,1-Dimethylethoxy)carbonyl]amino]-4-thiazolyl]-2-pentenedioic acid; tBPA

 

2-(2-tert-Butoxycarbonylaminothiazol-4-yl)-2-pentenedioic acid Chemical Properties

Molecule structure of 2-(2-tert-Butoxycarbonylaminothiazol-4-yl)-2-pentenedioic acid (CAS NO.103054-22-4):

Product Name: 2-(2-tert-Butoxycarbonylaminothiazol-4-yl)-2-pentenedioic acid 
Molecular Formula: C13H16N2O6S
Molecular Weight: 328.34 g/mol
CAS Registry Number: 103054-22-4 
Index of Refraction: 1.615
Molar Refractivity: 79.53 cm3
Molar Volume: 227.7 cm3
Polarizability: 31.53×10-24 cm3
Surface Tension: 65.8 dyne/cm
Density: 1.441 g/cm3 
SMILES: CC(C)(C)OC(=O)Nc1nc(cs1)C(=CCC(=O)O)C(=O)O
InChI: InChI=1/C13H16N2O6S/c1-13(2,3)21-12(20)15-11-14-8(6-22-11)7(10(18)19)4-5-9(16)17/h4,6H,5H2,1-3H3,(H,16,17)(H,18,19)(H,14,15,20)
InChIKey: WEQWVNVDIQJFJQ-UHFFFAOYAM
Std. InChI: InChI=1S/C13H16N2O6S/c1-13(2,3)21-12(20)15-11-14-8(6-22-11)7(10(18)19)4-5-9(16)17/h4,6H,5H2,1-3H3,(H,16,17)(H,18,19)(H,14,15,20) 
Std. InChIKey of 2-(2-tert-Butoxycarbonylaminothiazol-4-yl)-2-pentenedioic acid (CAS NO.103054-22-4): WEQWVNVDIQJFJQ-UHFFFAOYSA-N

2-(2-tert-Butoxycarbonylaminothiazol-4-yl)-2-pentenedioic acid Specification

 2-(2-tert-Butoxycarbonylaminothiazol-4-yl)-2-pentenedioic acid (CAS NO.103054-22-4) is also named as 2-Pentenedioic acid, 2-[2-[[(1,1-dimethylethoxy)carbonyl]amino]-4-thiazolyl]- ; 2-[2-[[(1,1-Dimethylethoxy)carbonyl]amino]-4-thiazolyl]-2-pentenedioic acid ; tBPA .

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