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CAS Number: 130525-39-2
2,7-di-tert-butyl-9,9-dimethyl-9H-xanthene-4,5-dicarboxylic acid

Structure

 2,7-di-tert-butyl-9,9-dimethyl-9H-xanthene-4,5-dicarboxylic acid
Name: 2,7-di-tert-butyl-9,9-dimethyl-9H-xanthene-4,5-dicarboxylic acid
Synonyms:
General Information
Product Number: 130525392

CAS Registry Number 130525-39-2
Name:
9H-?Xanthene-?4,?5-?dicarboxylic acid, 2,?7-?bis(1,?1-?dimethylethyl)?-?9,?9-?dimethyl-
2,7-Di(tert-butyl)-9,9-dimethyl-4,5-xanthenedicarboxylic acid

 

Chemical Formula: C25H30O5
Exact Mass: 410.21
Molecular Weight: 410.50
m/z: 410.21 (100.0%), 411.21 (27.2%), 412.22 (3.7%), 412.21 (1.0%)

 

InChI:InChI=1S/C25H30O5/c1-23(2,3)13-9-15(21(26)27)19-17(11-13)25(7,8)18-12-14(24(4,5)6)10-16(22(28)29)20(18)30-19/h9-12H,1-8H3,(H,26,27)(H,28,29)

InChI Key:VJSNHUACDSJJCU-UHFFFAOYSA-N

Canonical SMILES:CC1(C2=C(C(=CC(=C2)C(C)(C)C)C(=O)O)OC3=C1C=C(C=C3C(=O)O)C(C)(C)C)C

Specification

98%
References

(3) MacGillivray, Leonard R.; Journal of Chemical Crystallography 2002, V31(7-8), P373-376 CAPLUS
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