866039-43-2
Product Name:
4-([(2-CHLORO-1,3-THIAZOL-5-YL)METHYL]SULFANYL)BENZENECARBOXYLIC ACID
Formula:
C11H8ClNO2S2
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COMPUTED DESCRIPTORS
Molecular Weight | 285.8 g/mol |
---|---|
XLogP3 | 3.5 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 4 |
Exact Mass | 284.9684985 g/mol |
Monoisotopic Mass | 284.9684985 g/mol |
Topological Polar Surface Area | 104 Ų |
Heavy Atom Count | 17 |
Formal Charge | 0 |
Complexity | 272 |
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
4-[(2-chloro-5-thiazolyl)methylthio]benzoic acid is a sulfanylbenzoic acid.