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Amb10841295

Duplicate ID
CAS Number 1000339-64-9
Molecule Name 2-Methylsulfonyl-5-trifluoromethylbenzoic acid
2-Methylsulfonyl-5-trifluoromethylbenzoic acid
2-Methylsulfonyl-5-(trifluoromethyl)benzoic acid
2-(Methylsulphonyl)-5-(trifluoromethyl)benzoic acid
2-(Methylsulfonyl)-5-(trifluoromethyl)benzoic acid
SmilesOC(=O)c1cc(ccc1S(=O)(=O)C)C(F)(F)F
InchiKeyCBZHRYXIYMQKCF-UHFFFAOYSA-N
InChi InChI=1S/C9H7F3O4S/c1-17(15,16)7-3-2-5(9(10,11)12)4-6(7)8(13)14/h2-4H,1H3,(H,13,14)
Formula C9H7F3O4S
Molecular weight 268.21
Rings 1
logP 2.8879
PSA 79.82
MR 51.4973
Building Block
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