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Amb22001633

Duplicate ID
CAS Number 1000068-24-5
Molecule Name (1-(tert-Butoxycarbonyl)-7-chloro-1H-indol-2-yl)boronic acid
1H-Indole-1-carboxylic acid,2-borono-7-chloro-,1-(1,1-dimethylethyl)ester
SmilesCC(C)(C)OC(=O)[n]1c2c(Cl)cccc2cc1B(O)O
InchiKeyNXWDAFDCKRNQKL-UHFFFAOYSA-N
InChi InChI=1S/C13H15BClNO4/c1-13(2,3)20-12(17)16-10(14(18)19)7-8-5-4-6-9(15)11(8)16/h4-7,18-19H,1-3H3
Formula C13H15BClNO4
Molecular weight 295.527
Rings 2
logP 1.7577
PSA 71.69
MR 78.9756
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