5-Methoxy-2-mercaptobenzimidazole

• CAS: 37052-78-1
• Catalog Number: ACM37052781
• Category: Other Products
• Molecular Weight: 180.23
• Molecular Formula: C₈H₈N₂OS
• Synonyms: 5-Methoxye-2-mercaplobenzinidazole;TIMTEC-BB SBB000219;5-METHOXY-1H-BENZO[D]IMIDAZOLE-2-THIOL;5-Methoxybenzimidazole-2-thiol;5-METHOXY-2-THIOBENZIMIDAZOLE;5-METHOXY-2-MERCAPTOBENZIMIDAZOLE;5-METHOXY-2-BENZIMIDAZOLETHIOL;2-MERCAPTO-5-METHOXY-1H-BENZIMIDAZOLE
• Melting Point: 261-263°C(lit.)
• Hazard Statements: Xi,Xn
• Safety Description: 26-36
• Supplemental Hazard Statements: H315-H319-H335
• Symbol: GHS07

Custom Q&A

What is the molecular formula of 5-Methoxy-2-mercaptobenzimidazole?

The molecular formula is C8H8N2OS.

What is the molecular weight of 5-Methoxy-2-mercaptobenzimidazole?

The molecular weight is 180.23 g/mol.

What is the IUPAC name of 5-Methoxy-2-mercaptobenzimidazole?

The IUPAC name is 5-methoxy-1,3-dihydrobenzimidazole-2-thione.

What is the InChI of 5-Methoxy-2-mercaptobenzimidazole?

The InChI is InChI=1S/C8H8N2OS/c1-11-5-2-3-6-7(4-5)10-8(12)9-6/h2-4H,1H3,(H2,9,10,12).

What is the InChIKey of 5-Methoxy-2-mercaptobenzimidazole?

The InChIKey is KOFBRZWVWJCLGM-UHFFFAOYSA-N.

What is the canonical SMILES of 5-Methoxy-2-mercaptobenzimidazole?

The canonical SMILES is COC1=CC2=C(C=C1)NC(=S)N2.

What is the CAS number of 5-Methoxy-2-mercaptobenzimidazole?

The CAS number is 37052-78-1.

What is the molecular weight of 5-Methoxy-2-mercaptobenzimidazole according to PubChem?

The molecular weight is 180.23 g/mol according to PubChem.

What is the XLogP3-AA value of 5-Methoxy-2-mercaptobenzimidazole?

The XLogP3-AA value is 1.1.

How many hydrogen bond donor and acceptor counts does 5-Methoxy-2-mercaptobenzimidazole have?

It has 2 hydrogen bond donor counts and 2 hydrogen bond acceptor counts.

Synthetic Use

Upstream Synthesis Route 1

• 75-15-0
• 5472-37-7

• 37052-78-1
• 84445-85-2

Reference: [1]Chemical and pharmaceutical bulletin,1982,vol. 30,p. 2714 - 2722

Downstream Synthesis Route 1

• 67-56-1
• 37052-78-1

• 4887-80-3

Reference: [1] Synthetic Communications, 2010, vol. 40, # 20, p. 2983 - 2987

Downstream Synthesis Route 2

• 64-17-5
• 37052-78-1

• 4887-80-3

Reference: [1] Synthetic Communications, 2010, vol. 40, # 20, p. 2983 - 2987

Downstream Synthesis Route 3

• 37052-78-1
• 100-51-6

• 4887-80-3

Reference: [1] Synthetic Communications, 2010, vol. 40, # 20, p. 2983 - 2987

Downstream Synthesis Route 4

• 125163-08-8
• 37052-78-1

• 104658-73-3

Reference: [1]Chemical and Pharmaceutical Bulletin,1989,vol. 37,p. 1517 - 1523

* For details of the synthesis route, please refer to the original source to ensure accuracy.