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1,3-Dihydrobenzimidazole-2-Thione
[CAS# 2080-59-3]

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Identification
Name 1,3-Dihydrobenzimidazole-2-Thione
Synonyms Zinc00093995; Inchi=1/C7h6n2s/C10-7-8-5-3-1-2-4-6(5)9-7/H1-4H,(H2,8,9,10; 1,3-Dihydro-2H-Benzimidazole-2-Thione
Molecular Structure CAS#: 2080-59-3, 1,3-Dihydrobenzimidazole-2-Thione
Molecular Formula C7H6N2S
Molecular Weight 150.20
CAS Registry Number 2080-59-3
SMILES C1=CC=CC2=C1NC(=S)N2
InChI 1S/C7H6N2S/c10-7-8-5-3-1-2-4-6(5)9-7/h1-4H,(H2,8,9,10)
InChIKey YHMYGUUIMTVXNW-UHFFFAOYSA-N
Properties
Density 1.4±0.1g/cm3 (Cal.)
1.42 (Expl.)
Melting point 301-305°C (Expl.)
Boiling point 332.1±25.0°C at 760 mmHg (Cal.)
Flash point 154.7±23.2°C (Cal.)
250°C (Expl.)
solubility Soluble in alcohol
Safety Data
Safety Code S36;S60  Details
Risk Code R22  Details
Hazard Symbol symbol  X  Details
Transport Information UN2811
Safety Description WARNING: Irritates skin and eyes, harmful if swallowed
DANGER: POISON, irritates skin, eyes, lungs
Safety glasses, adequate ventilation.
References
(1) Ruiting Liu, Xiaoqing Li, Houcai Zhang, Linhong Weng and Xigeng Zhou. Synthesis and controlled hydrolysis of organolanthanide complexes with mono- and dianionic benzimidazole-2-thiolate ligands, Dalton Trans., 2010, 39, 11053.
Market Analysis Reports
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