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CAS Number: 1138-52-9
3,5-di-tert-butylphenol

Structure

3,5-di-tert-butylphenol
Name: 3,5-di-tert-butylphenol
Synonyms:
General Information
Product Number: 1138529

CAS Registry Number 1138-52-9
Name:
Phenol, 3,?5-?bis(1,?1-?dimethylethyl)?-
Phenol, 3,5-di-tert-butyl- (7CI,8CI)
3,5-Bis(1,1-dimethylethyl)phenol
3,5-Bis(tert-butyl)phenol
3,5-Di-t-butylphenol
3,5-Di-tert-butylphenol

 

Chemical Formula: C14H22O
Exact Mass: 206.17
Molecular Weight: 206.32
m/z: 206.17 (100.0%), 207.17 (15.4%), 208.17 (1.3%)

 

InChI:InChI=1S/C14H22O/c1-13(2,3)10-7-11(14(4,5)6)9-12(15)8-10/h7-9,15H,1-6H3

InChI Key:ZDWSNKPLZUXBPE-UHFFFAOYSA-N

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

Specification

98%

References
  1. (1) Jover, Jesus; QSAR & Combinatorial Science 2007, V26(3), P385-397 CAPLUS
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