78979-64-3
Product Name:
2-(4-NITRO-PHENYL)-THIAZOLE-4-CARBOXYLIC ACID ETHYL ESTER
Formula:
C12H10N2O4S
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Solubility | 5.6 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
Molecular Weight | 278.29 g/mol |
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XLogP3 | 3 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 4 |
Exact Mass | 278.03612798 g/mol |
Monoisotopic Mass | 278.03612798 g/mol |
Topological Polar Surface Area | 113 Ų |
Heavy Atom Count | 19 |
Formal Charge | 0 |
Complexity | 339 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
2-(4-nitrophenyl)-4-thiazolecarboxylic acid ethyl ester is a C-nitro compound.