ethyl 7-fluoro-5-(methylsulfonyl)-1H-indole-2-carboxylate

Base Information

• Chemical Name: ethyl 7-fluoro-5-(methylsulfonyl)-1H-indole-2-carboxylate
• CAS No.: 849035-83-2
• Molecular Formula: C12H12 F N O4 S
• Molecular Weight: 285.29
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID30382245
• Wikidata: Q82173555
• Mol file: 849035-83-2.mol

Synonyms:849035-83-2;ethyl 7-fluoro-5-(methylsulfonyl)-1H-indole-2-carboxylate;ethyl 7-fluoro-5-methylsulfonyl-1H-indole-2-carboxylate;DTXSID30382245;ethyl 7-fluoro-5-methanesulfonyl-1H-indole-2-carboxylate;AKOS015959069;A840994;ethyl 7-fluoranyl-5-methylsulfonyl-1H-indole-2-carboxylate;Ethyl 7-fluoro-5-(methanesulfonyl)-1H-indole-2-carboxylate;Ethyl 7-fluoro-5-(methylsulphonyl)-1H-indole-2-carboxylate;ethyl7-fluoro-5-(methylsulfonyl)-1H-indole-2-carboxylate;7-fluoro-5-methylsulfonyl-1H-indole-2-carboxylic acid ethyl ester

Chemical Property of ethyl 7-fluoro-5-(methylsulfonyl)-1H-indole-2-carboxylate

Chemical Property:

• Vapor Pressure: 1.18E-10mmHg at 25°C
• Melting Point: 193-195°C (dec.)
• Refractive Index: 1.582
• Boiling Point: 513.4°C at 760 mmHg
• Flash Point: 264.3°C
• PSA: 84.61000
• Density: 1.41g/cm³
• LogP: 2.96800
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 285.04710720
• Heavy Atom Count: 19
• Complexity: 447

Purity/Quality:

99% ^*data from raw suppliers

ETHYL 7-FLUORO-5-(METHYLSULFONYL)-1H-INDOLE-2-CARBOXYLATE 95.00% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=CC2=CC(=CC(=C2N1)F)S(=O)(=O)C