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CAS Number: 860624-87-9
1-tert-butyl 7-methyl 5-bromoindoline-1,7-dicarboxylate

Structure

1-tert-butyl 7-methyl 5-bromoindoline-1,7-dicarboxylate
Name: 1-tert-butyl 7-methyl 5-bromoindoline-1,7-dicarboxylate
Synonyms:
General Information
Product Number: 860624879

CAS Registry Number 860624-87-9
Name:
1H-​Indole-​1,​7-​dicarboxylic acid, 5-​bromo-​2,​3-​dihydro-​, 1-​(1,​1-​dimethylethyl) 7-​methyl ester
1,1-Dimethylethyl 7-(methoxycarbonyl)-5-bromo-2,3-dihydro-1H-indole-1-carboxylate

 

Chemical Formula: C15H18BrNO4
Exact Mass: 355.04
Molecular Weight: 356.21
m/z: 355.04 (100.0%), 357.04 (97.3%), 356.05 (16.6%), 358.04 (16.3%), 357.05 (2.1%), 359.05 (1.3%)

 

InChI:InChI=1S/C15H18BrNO4/c1-15(2,3)21-14(19)17-6-5-9-7-10(16)8-11(12(9)17)13(18)20-4/h7-8H,5-6H2,1-4H3

InChI Key:CULROCIUGVJNGP-UHFFFAOYSA-N

Canonical SMILES:CC(C)(C)OC(=O)N1CCC2=C1C(=CC(=C2)Br)C(=O)OC

Specification

98%

References

PCT Int. Appl. (2008), WO 2008118724 A1 20081002.                                  

PCT Int. Appl. (2007), WO 2007062318 A2 20070531.

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