4-[(2-Chloro-4-Nitrophenyl)Azo]-2,4-Dihydro-5-Methyl-2-(Tetrahydro-3-Thienyl)-3H-Pyrazol-3-One S,S-Dioxide
[CAS# 62308-14-9]

Identification

• Name: 4-[(2-Chloro-4-Nitrophenyl)Azo]-2,4-Dihydro-5-Methyl-2-(Tetrahydro-3-Thienyl)-3H-Pyrazol-3-One S,S-Dioxide
• Synonyms: 4-(2-Chloro-4-Nitro-Phenyl)Azo-2-(1,1-Dioxothiolan-3-Yl)-5-Methyl-4H-Pyrazol-3-One; 4-(2-Chloro-4-Nitrophenyl)Azo-2-(1,1-Dioxo-3-Thiolanyl)-5-Methyl-4H-Pyrazol-3-One; 4-(2-Chloro-4-Nitro-Phenyl)Azo-2-(1,1-Diketothiolan-3-Yl)-5-Methyl-4H-Pyrazol-3-One
• Molecular Formula: C₁₄H₁₄ClN₅O₅S
• Molecular Weight: 399.81
• CAS Registry Number: 62308-14-9
• EINECS: 263-499-6
• SMILES: C1=C(C(=CC=C1[N+](=O)[O-])N=NC2C(=O)N(N=C2C)C3CC[S](=O)(=O)C3)Cl
• InChI: 1S/C14H14ClN5O5S/c1-8-13(14(21)19(18-8)10-4-5-26(24,25)7-10)17-16-12-3-2-9(20(22)23)6-11(12)15/h2-3,6,10,13H,4-5,7H2,1H3
• InChIKey: FNRBXWCMRXIJBE-UHFFFAOYSA-N

Properties

• Density: 1.748g/cm³ (Cal.)
• Boiling point: 635.872°C at 760 mmHg (Cal.)
• Flash point: 338.364°C (Cal.)