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4433-52-7 | benzothiazoline
CAS No: 4433-52-7 Catalog No: AG00DJQ7 MDL No:
Product Description
Catalog Number:
AG00DJQ7
Chemical Name:
benzothiazoline
CAS Number:
4433-52-7
IUPAC Name:
2,3-dihydro-1,3-benzothiazole
InChI:
InChI=1S/C7H7NS/c1-2-4-7-6(3-1)8-5-9-7/h1-4,8H,5H2
InChI Key:
WOHLSTOWRAOMSG-UHFFFAOYSA-N
NSC Number:
81218
Properties
Complexity:
105
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.03g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
137.2g/mol
Monoisotopic Mass:
137.03g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Literature
| Title | Journal |
|---|---|
| A 96-well filtration method for radioligand binding analysis of σ receptor ligands. | Journal of pharmaceutical and biomedical analysis 20121201 |
| Chiral phosphoric acid catalyzed enantioselective transfer deuteration of ketimines by use of benzothiazoline as a deuterium donor: synthesis of optically active deuterated amines. | Organic letters 20120706 |
| Enantioselective organocatalytic reductive amination of aliphatic ketones by benzothiazoline as hydrogen donor. | Chemical communications (Cambridge, England) 20120514 |
| 4'-tert-Butyl-5-chloro-3H-spiro-[1,3-benzothia-zole-2,1'-cyclo-hexa-ne]. | Acta crystallographica. Section E, Structure reports online 20120501 |
| Estimation of σ- and π-donor properties of heterocyclic thioamides by spectroscopic and magnetic resonance methods. | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20111015 |
| Advantages of isothermal titration calorimetry for xylanase kinetics in comparison to chemical-reducing-end assays. | Analytical biochemistry 20110301 |
| Palladium(II) and platinum(II) derivatives of benzothiazoline ligands: Synthesis, characterization, antimicrobial and antispermatogenic activity. | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20110101 |
| Experimental and density functional theory and ab initio Hartree-Fock study on the vibrational spectra of 5-chloro-6-(4-chlorobenzoyl)-2-benzothiazolinone molecule. | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20090501 |
| Predicting the binding capability of benzothiazoline-2-thione and its derivatives with gold: a DFT and FT-Raman combined studies. | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20081215 |
| One-pot synthesis of benzothiazolines and napthathiazolines via cascade ortho-lithiation, cyclisation and elimination of N-arylsulfonyl lactams. | Organic & biomolecular chemistry 20071107 |
| A fission yeast strain expressing human CDC25A phosphatase: a tool for selectivity studies of pharmacological inhibitors of CDC25. | Current genetics 20040501 |
| Interaction of metal ions with D-glucobenzothiazoline: isolation and characterization of the resultant products. | Carbohydrate research 20020218 |
| Azole-linked coumarin dyes as fluorescence probes of domain-forming polymers. | Journal of photochemistry and photobiology. B, Biology 20011201 |
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