3-FLUORO-4-(1H-1,2,4-TRIAZOL-5-YLSULFANYL)BENZOIC ACID

CAS No.
CCD No.
CCD03233047
Formula
C9 H6 F N3 O2 S
MolWeight
239.229

Basic Information

Product Name: 3-FLUORO-4-(1H-1,2,4-TRIAZOL-5-YLSULFANYL)BENZOIC ACID
English Synonyms: 3-FLUORO-4-(1H-1,2,4-TRIAZOL-5-YLSULFANYL)BENZOIC ACID
MDL Number.: MFCD16852976
H bond acceptor: 5
H bond donor: 2
Smile: c1cc(c(cc1C(=O)O)F)Sc2[nH]ncn2
InChi: InChI=1S/C9H6FN3O2S/c10-6-3-5(8(14)15)1-2-7(6)16-9-11-4-12-13-9/h1-4H,(H,14,15)(H,11,12,13)
InChiKey: InChIKey=OCCWIDZYDOWENA-UHFFFAOYSA-N

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