structure of 1H-Indole-1-carboxylic acid, 2-borono-7-methyl-, 1-(1,1-dimethylethyl) ester

1H-Indole-1-carboxylic acid, 2-borono-7-methyl-, 1-(1,1-dimethylethyl) ester

CAS No.: 1000068-66-5
M. Wt: 275.10800
M. Fa: C14H18BNO4
InChI Key: XKVDBDOIYHSBCS-UHFFFAOYSA-N

Names and Identifiers of 1000068-66-5

CAS Number

1000068-66-5

IUPAC Name

[7-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]indol-2-yl]boronic acid

InChI

InChI=1S/C14H18BNO4/c1-9-6-5-7-10-8-11(15(18)19)16(12(9)10)13(17)20-14(2,3)4/h5-8,18-19H,1-4H3

InChIKey

XKVDBDOIYHSBCS-UHFFFAOYSA-N

Canonical SMILES

B(C1=CC2=CC=CC(=C2N1C(=O)OC(C)(C)C)C)(O)O

Physical and chemical properties of 1000068-66-5

Exact Mass

275.13300

LogP

1.41270

Molecular Formula

C14H18BNO4

Molecular Weight

275.10800

PSA

71.69000

Safety Information of 1000068-66-5

Pictograms

Signal Word

 Warning

Safety Data Sheet
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