(S)-fipronil

Base Information

• Chemical Name: (S)-fipronil
• CAS No.: 302578-96-7
• Molecular Formula: C12H4Cl2F6N4OS
• UNII: 42M76BR9DT
• DSSTox Substance ID: DTXSID301019554
• Wikidata: Q27156804
• Mol file: 302578-96-7.mol

Synonyms:(S)-fipronil;(+)-fipronil;S-(+)-Fipronil;Fipronil, (S)-;42M76BR9DT;UNII-42M76BR9DT;302578-96-7;1H-Pyrazole-3-carbonitrile, 5-amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-((S)-(trifluoromethyl)sulfinyl)-;5-Amino-1-(2,6-dichloro-4-(trifluoromethyl)phenyl)-4-((S)-(trifluoromethyl)sulfinyl)-1H-pyrazole-3-carbonitrile;5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(S)-trifluoromethylsulfinyl]pyrazole-3-carbonitrile;5-amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(S)-(trifluoromethyl)sulfinyl]-1H-pyrazole-3-carbonitrile;(S)-(+)-fipronil;SCHEMBL44222;CHEBI:83396;ZOCSXAVNDGMNBV-SANMLTNESA-N;DTXSID301019554;NS00116672;Q27156804;5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(trifluoromethane)sulfinyl]-1H-pyrazole-3-carbonitrile

Chemical Property of (S)-fipronil

Chemical Property:

• XLogP3: 4.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 2
• Exact Mass: 435.9387063
• Heavy Atom Count: 26
• Complexity: 599

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F
• Isomeric SMILES: C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)[S@](=O)C(F)(F)F)N)Cl)C(F)(F)F