CAS 93794-45-7

5-Chloro-7-methyl-2(3H)-benzoxazolethione

Description:

5-Chloro-7-methyl-2(3H)-benzoxazolethione, with the CAS number 93794-45-7, is a heterocyclic compound characterized by the presence of a benzoxazole ring fused with a thione functional group. This compound typically exhibits a pale yellow to light brown solid appearance and is soluble in organic solvents. The presence of chlorine and methyl groups contributes to its unique chemical reactivity and potential biological activity. It may exhibit properties such as antimicrobial or antifungal activity, making it of interest in pharmaceutical and agricultural applications. The thione group can participate in various chemical reactions, including nucleophilic attacks, which can be exploited in synthetic chemistry. Additionally, the compound's stability and reactivity can be influenced by environmental factors such as pH and temperature. As with many heterocycles, it may also display fluorescence properties, which can be useful in analytical applications. Overall, 5-Chloro-7-methyl-2(3H)-benzoxazolethione is a compound of interest for further research in both synthetic and applied chemistry contexts.

Formula: C₈H₆ClNOS

InChI: InChI=1S/C8H6ClNOS/c1-4-2-5(9)3-6-7(4)11-8(12)10-6/h2-3H,1H3,(H,10,12)

InChI key: InChIKey=MBALKXWCAQHOJI-UHFFFAOYSA-N

SMILES: CC1=C2C(NC(=S)O2)=CC(Cl)=C1

Synonyms:

• 5-Chloro-7-methyl-2(3H)-benzoxazolethione
• 5-Chloro-2-mercapto-7-methylbenzoxazole
• 2(3H)-Benzoxazolethione, 5-chloro-7-methyl-
• 5-Chloro-7-methyl-2-mercaptobenzoxazole

5-Chloro-7-methyl-1,3-benzoxazole-2-thiol

CAS: 93794-45-7

5-Chloro-7-methyl-1,3-benzoxazole-2-thiol

Purity: 97%

Molecular weight: 199.66g/mol

Ref: 54-OR1036195

5-chloro-7-methyl-2,3-dihydro-1,3-benzoxazole-2-thione

CAS: 93794-45-7

Purity: 97%

Molecular weight: 199.6499939

Ref: 10-F673277

5-Chloro-7-methyl-1,3-benzoxazole-2-thiol

CAS: 93794-45-7

5-Chloro-7-methyl-1,3-benzoxazole-2-thiol is a benzoxazole that has been shown to have high binding affinity for the 5HT3 receptor in the distal colon. It has been proposed as a potential therapeutic agent for irritable bowel syndrome (IBS). This compound may be useful for treating IBS because it has been shown to act as an antagonist of the 5HT3 receptor, which is involved in the regulation of visceral pain. 5Chloro-7-methyl-1,3-benzoxazole-2-thiol does not bind to other receptors and does not show any agonist activity.

Formula: C₈H₆ClNOS

Purity: Min. 95%

Molecular weight: 199.66 g/mol

Ref: 3D-TDA79445