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I01-1361 4-(Trifluoromethylthio)benzoic acid (CAS# 330-17-6)
General Information
Catalog No.:
I01-1361
Synonym:
Cas#:
330-17-6
MDL# :
MFCD00040906
Molecular Formula:
C8H5F3O2S
Mole Weight:
222.0
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Formula C8H5F3O2S
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O=C(O)C1=CC=C(SC(F)(F)F)C=C1 CDK 05191218382D 14 14 0 0 0 0 999 V2000 0.0000 2.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 2.0625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 2.4750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 1.2375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -1.2375 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -1.6500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 -2.0625 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0164 -2.3645 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1.8414 -0.9355 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 7 13 1 0 0 0 0 13 14 2 0 0 0 0 4 14 1 0 0 0 0 M END
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