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Home Other Building Blocks 2,6-Di(tert-butyl)-4-hydroxy-4-methyl-2,5-cyclohexadien-1-one

2,6-Di(tert-butyl)-4-hydroxy-4-methyl-2,5-cyclohexadien-1-one

CAS No.:
10396-80-2
Catalog Number:
AG007WVJ
Molecular Formula:
C15H24O2
Molecular Weight:
236.3499
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$88
- +
250mg
95%
In Stock USA
United States
$175
- +
500mg
95%
In Stock USA
United States
$313
- +
1g
95%
In Stock USA
United States
$575
- +
Product Description
Catalog Number:
AG007WVJ
Chemical Name:
2,6-Di(tert-butyl)-4-hydroxy-4-methyl-2,5-cyclohexadien-1-one
CAS Number:
10396-80-2
Molecular Formula:
C15H24O2
Molecular Weight:
236.3499
MDL Number:
MFCD01734499
IUPAC Name:
2,6-ditert-butyl-4-hydroxy-4-methylcyclohexa-2,5-dien-1-one
InChI:
InChI=1S/C15H24O2/c1-13(2,3)10-8-15(7,17)9-11(12(10)16)14(4,5)6/h8-9,17H,1-7H3
InChI Key:
DQBHJILNHNRDTM-UHFFFAOYSA-N
SMILES:
O=C1C(=CC(C=C1C(C)(C)C)(C)O)C(C)(C)C
UNII:
RCK267MPS5
Properties
Complexity:
364  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.178g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
236.355g/mol
Monoisotopic Mass:
236.178g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Literature
Title Journal
Screening of endocrine activity of compounds migrating from plastic baby bottles using a multi-receptor panel of in vitro bioassays. Toxicology in vitro : an international journal published in association with BIBRA 20161201
Lung toxicity and tumor promotion by hydroxylated derivatives of 2,6-di-tert-butyl-4-methylphenol (BHT) and 2-tert-butyl-4-methyl-6-iso-propylphenol: correlation with quinone methide reactivity. Chemical research in toxicology 20020801
Down-regulation by butylated hydroxytoluene of the number and function of gap junctions in epithelial cell lines derived from mouse lung and rat liver. Carcinogenesis 19951001
Properties