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Amb10069315

Duplicate ID
CAS Number 1000018-49-4
Molecule Name 3-(2,6-Dimethylmorpholin-4-yl)-4-methylsulfonylbenzoic acid
3-(2,6-Dimethylmorpholin-4-yl)-4-(methylsulphonyl)benzoic acid
SmilesCC1OC(C)CN(C1)c1cc(ccc1S(=O)(=O)C)C(=O)O
InchiKeyKUHMXFFFEAEMPI-UHFFFAOYSA-N
InChi InChI=1S/C14H19NO5S/c1-9-7-15(8-10(2)20-9)12-6-11(14(16)17)4-5-13(12)21(3,18)19/h4-6,9-10H,7-8H2,1-3H3,(H,16,17)
Formula C14H19NO5S
Molecular weight 313.369
Rings 2
logP 2.5477
PSA 92.29
MR 81.8363
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