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CAS Number: 167993-12-6
di-tert-butyl 5-aminoisophthalate

Structure

 di-tert-butyl 5-aminoisophthalate
Name: di-tert-butyl 5-aminoisophthalate
Synonyms:
General Information
Product Number: 167993126

CAS Registry Number 167993-12-6
Name:
1,?3-?Benzenedicarboxylic acid, 5-?amino-?, 1,?3-?bis(1,?1-?dimethylethyl) ester
1,3-Benzenedicarboxylic acid, 5-amino-, bis(1,1-dimethylethyl) ester (9CI)
Di-tert-butyl 5-aminoisophthalate

 

Chemical Formula: C16H23NO4
Exact Mass: 293.16
Molecular Weight: 293.36
m/z: 293.16 (100.0%), 294.17 (17.7%), 295.17 (2.3%)

 

InChI:InChI=1S/C16H23NO4/c1-15(2,3)20-13(18)10-7-11(9-12(17)8-10)14(19)21-16(4,5)6/h7-9H,17H2,1-6H3

InChI Key:ZLLMUGBKHWIFJC-UHFFFAOYSA-N

Canonical SMILES:CC(C)(C)OC(=O)C1=CC(=CC(=C1)N)C(=O)OC(C)(C)C

Specification

98%
References

PCT Int. Appl. (2007), WO 2007068188 A1 20070621.                                  

PCT Int. Appl. (1995), WO 9504720 A2 19950216.                                 
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