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Amb6674941

Duplicate ID
CAS Number 1000018-43-8
Molecule Name 5-(4-Methylpiperidin-1-yl)-2-nitrobenzoic acid
5-(4-Methylpiperidin-1-yl)-2-nitrobenzoic acid
SmilesCC1CCN(CC1)c1ccc(c(c1)C(=O)O)[N+](=O)[O-]
InchiKeyODABWBXUJQQXPO-UHFFFAOYSA-N
InChi InChI=1S/C13H16N2O4/c1-9-4-6-14(7-5-9)10-2-3-12(15(18)19)11(8-10)13(16)17/h2-3,8-9H,4-7H2,1H3,(H,16,17)
Formula C13H16N2O4
Molecular weight 264.277
Rings 2
logP 3.1175
PSA 86.36
MR 76.4793
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