2-(Chloromethyl)benzothiazole - CAS 37859-43-1
Catalog: |
BB023449 |
Product Name: |
2-(Chloromethyl)benzothiazole |
CAS: |
37859-43-1 |
Synonyms: |
2-(chloromethyl)-1,3-benzothiazole; 2-(chloromethyl)-1,3-benzothiazole |
IUPAC Name: | 2-(chloromethyl)-1,3-benzothiazole |
Description: | 2-(Chloromethyl)benzothiazole (CAS# 37859-43-1) is a useful research chemical. |
Molecular Weight: | 183.66 |
Molecular Formula: | C8H6ClNS |
Canonical SMILES: | C1=CC=C2C(=C1)N=C(S2)CCl |
InChI: | InChI=1S/C8H6ClNS/c9-5-8-10-6-3-1-2-4-7(6)11-8/h1-4H,5H2 |
InChI Key: | SERUZNHRWBXDOX-UHFFFAOYSA-N |
Boiling Point: | 274 °C at 760 mmHg |
Density: | 1.371 g/cm3 |
MDL: | MFCD05664944 |
LogP: | 3.03510 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P272, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P333+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-111362885-A | Benzothiazole ring substituted aminophenol oxygen radical zinc complex and preparation method and application thereof | 20200306 |
WO-2020146822-A1 | Leukotriene synthesis inhibitors | 20190111 |
CN-108774194-A | A kind of preparation method of 2- [(2-[4-morpholinodithio methyl) sulfenyl] -6- ethoxyl benzo thiazoles and its intermediate | 20180723 |
EP-3315495-A1 | N,n' -diarylurea, n,n' -diarylthiourea and n,n' -diarylguanidino compounds for use in treatment and prevention of inflammatory disease | 20161025 |
WO-2018077898-A1 | N,n'-diarylurea, n,n'-diarylthiourea and n,n'-diarylguanidino compounds for use in treatment and prevention of inflammatory disease | 20161025 |
Complexity: | 142 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 182.9909481 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 182.9909481 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 41.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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