2-Amino-5-fluorobenzothiazole - CAS 20358-07-0
Catalog: |
BB015836 |
Product Name: |
2-Amino-5-fluorobenzothiazole |
CAS: |
20358-07-0 |
Synonyms: |
5-fluoro-1,3-benzothiazol-2-amine; 5-fluoro-1,3-benzothiazol-2-amine |
IUPAC Name: | 5-fluoro-1,3-benzothiazol-2-amine |
Description: | 2-Amino-5-fluorobenzothiazole (CAS# 20358-07-0) is a useful research chemical. |
Molecular Weight: | 168.19 |
Molecular Formula: | C7H5FN2S |
Canonical SMILES: | C1=CC2=C(C=C1F)N=C(S2)N |
InChI: | InChI=1S/C7H5FN2S/c8-4-1-2-6-5(3-4)10-7(9)11-6/h1-3H,(H2,9,10) |
InChI Key: | YHBIGBYIUMCLJS-UHFFFAOYSA-N |
Boiling Point: | 312 °C at 760 mmHg |
Density: | 1.491 g/cm3 |
MDL: | MFCD05664560 |
LogP: | 2.59880 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2019169158-A1 | Novel antimycobacterial heterocyclic amides | 20180228 |
EP-3758697-A1 | Novel antimycobacterial heterocyclic amides | 20180228 |
US-2021002239-A1 | Novel Antimycobacterial Heterocyclic Amides | 20180228 |
JP-2021516230-A | New anti-mycobacterial heterocyclic amide | 20180228 |
CA-3003930-A1 | Antibiotic compounds, pharmaceutical formulations thereof and methods and uses therefor | 20151104 |
PMID | Publication Date | Title | Journal |
22199773 | 20111201 | 6-Fluoro-2-(4-meth-oxy-phen-yl)imidazo[2,1-b][1,3]benzothia-zole | Acta crystallographica. Section E, Structure reports online |
Complexity: | 155 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 168.01574750 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 168.01574750 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 67.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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