2-Amino-6-chlorobenzothiazole - CAS 95-24-9
Catalog: |
BB041657 |
Product Name: |
2-Amino-6-chlorobenzothiazole |
CAS: |
95-24-9 |
Synonyms: |
6-chloro-1,3-benzothiazol-2-amine |
IUPAC Name: | 6-chloro-1,3-benzothiazol-2-amine |
Description: | 2-Amino-6-chlorobenzothiazole (CAS# 95-24-9) is a useful research chemical. |
Molecular Weight: | 184.65 |
Molecular Formula: | C7H5ClN2S |
Canonical SMILES: | C1=CC2=C(C=C1Cl)SC(=N2)N |
InChI: | InChI=1S/C7H5ClN2S/c8-4-1-2-5-6(3-4)11-7(9)10-5/h1-3H,(H2,9,10) |
InChI Key: | VMNXKIDUTPOHPO-UHFFFAOYSA-N |
Boiling Point: | 344.3 °C at 760 mmHg |
Purity: | 97 % |
Density: | 1.532 g/cm3 |
Appearance: | Off-white to light beige crystalline powder |
MDL: | MFCD00053557 |
LogP: | 3.11310 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113045993-A | Polishing solution for processing ultra-smooth low-damage bearing steel surface and application thereof | 20210325 |
CN-111978756-A | Method for enhancing alkali resistance and oxidation resistance of benzothiazole disperse dye | 20200827 |
CN-111978756-B | Method for enhancing alkali resistance and oxidation resistance of benzothiazole disperse dye | 20200827 |
KR-20210076879-A | Novel pyrimidine derivatives and use thereof | 20191216 |
WO-2021125803-A1 | Novel pyrimidin derivative and use thereof | 20191216 |
PMID | Publication Date | Title | Journal |
22412583 | 20120301 | 1-(6-Chloro-1,3-benzothia-zol-2-yl)hydrazine | Acta crystallographica. Section E, Structure reports online |
15962942 | 20050601 | Prediction of genotoxicity of chemical compounds by statistical learning methods | Chemical research in toxicology |
Complexity: | 155 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 183.9861970 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 183.9861970 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 67.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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