1-[(5-Methoxy-1-Methyl-1H-Benzimidazol-2-Yl)Sulfanyl]-3,3-Dimethyl-2-Butanone
[CAS 302929-96-0]

Identification

• Name: 1-[(5-Methoxy-1-Methyl-1H-Benzimidazol-2-Yl)Sulfanyl]-3,3-Dimethyl-2-Butanone
• Synonyms: 1-[(5-methoxy-1-methyl-1H-benzimidazol-2-yl)thio]-3,3-dimethyl-2-butanone; 1-[(5-methoxy-1-methyl-1H-benzimidazol-2-yl)thio]-3,3-dimethylbutan-2-one; MLS000579127
• Molecular Formula: C₁₅H₂₀N₂O₂S
• Molecular Weight: 292.40
• CAS Registry Number: 302929-96-0
• SMILES: CC(C)(C)C(=O)CSC1=NC2=C(N1C)C=CC(=C2)OC
• InChI: 1S/C15H20N2O2S/c1-15(2,3)13(18)9-20-14-16-11-8-10(19-5)6-7-12(11)17(14)4/h6-8H,9H2,1-5H3
• InChIKey: VGIUEAVXLPQMSX-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 436.7±51.0°C at 760 mmHg (Cal.)
• Flash point: 217.9±30.4°C (Cal.)
• Refractive index: 1.575 (Cal.)