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2-Mercaptobenzimidazole

Catalog Number
ACM583391-2
CAS Number
583-39-1
Product Name
2-Mercaptobenzimidazole
Structure
Category
Plastic Additives
Synonyms
1H-Benzoimidazole-2-thiol
Description
2-mercaptobenzimidazole appears as white to yellow crystals or cream colored powder. Slight odor. (NTP, 1992)
IUPAC Name
1,3-Dihydrobenzimidazole-2-thione
Molecular Weight
150.2
Molecular Formula
C7H6N2S
Canonical SMILES
C1=CC=C2C(=C1)NC(=S)N2
InChI
InChI=1S/C7H6N2S/c10-7-8-5-3-1-2-4-6(5)9-7/h1-4H,(H2,8,9,10)
InChI Key
YHMYGUUIMTVXNW-UHFFFAOYSA-N
Boiling Point
270.6±23.0 °C
Melting Point
300-304 °C
Purity
98%+
Density
1.42 (NTP, 1992)
Solubility
Slightly soluble in hot water
Appearance
Powder
Application
2-Mercaptobenzimidazole serves multiple purposes across various industries due to its versatile properties. Primarily, it acts as an antidegradant, offering protection to rubber against oxidative damage. In the pharmaceutical sector, it functions as an important intermediate in the synthesis of rabeprazole and is incorporated into certain anti-leprosy medications. Additionally, its utility extends to the field of electrochemistry, where it acts as a copper plating brightener and a corrosion inhibitor capable of safeguarding metals like copper and mild steel. Furthermore, it is effective in removing mercury (II) from aqueous solutions, making it valuable for treating wastewater in the chlor-alkali industry.
Storage
2-8 °C
Complexity
142
Covalently-Bonded Unit Count
1
EC Number
209-502-6;604-756-8
Exact Mass
150.02516937
Formal Charge
0
Heavy Atom Count
10
Hydrogen Bond Acceptor Count
1
Hydrogen Bond Donor Count
2
Log P
1.66 (LogP)
MeSH Entry Terms
2-mercaptobenzimidazole;2-mercaptobenzimidazole, monosodium salt;2-mercaptobenzimidazole, zinc (2:1) salt
Monoisotopic Mass
150.02516937
NSC Number
186246;21414
Rotatable Bond Count
0
RTECS Number
DE1050000
Topological Polar Surface Area
56.2 Ų
UNII
619CVM6HOK
UN Number
2811
Vapor Pressure
30.2 mm Hg at 142 °F (NTP, 1992)
XLogP3
1.7
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