Home Other Building Blocks 6,6'-Methylenebis(2-(tert-butyl)-4-methylphenol)

6,6'-Methylenebis(2-(tert-butyl)-4-methylphenol)

CAS No.:
119-47-1
Catalog Number:
AG003B3E
Molecular Formula:
C23H32O2
Molecular Weight:
340.4990
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
99%(GC)
In Stock USA
United States
$39
- +
25g
99%(GC)
In Stock USA
United States
$54
- +
100g
99%(GC)
In Stock USA
United States
$82
- +
250g
99%(GC)
In Stock USA
United States
$110
- +
500g
99%(GC)
In Stock USA
United States
$194
- +
Product Description
Catalog Number:
AG003B3E
Chemical Name:
6,6'-Methylenebis(2-(tert-butyl)-4-methylphenol)
CAS Number:
119-47-1
Molecular Formula:
C23H32O2
Molecular Weight:
340.4990
MDL Number:
MFCD00043641
IUPAC Name:
2-tert-butyl-6-[(3-tert-butyl-2-hydroxy-5-methylphenyl)methyl]-4-methylphenol
InChI:
InChI=1S/C23H32O2/c1-14-9-16(20(24)18(11-14)22(3,4)5)13-17-10-15(2)12-19(21(17)25)23(6,7)8/h9-12,24-25H,13H2,1-8H3
InChI Key:
KGRVJHAUYBGFFP-UHFFFAOYSA-N
SMILES:
Cc1cc(Cc2cc(C)cc(c2O)C(C)(C)C)c(c(c1)C(C)(C)C)O
EC Number:
204-327-1
UNII:
KVM0X4X57B
NSC Number:
7781
Properties
Complexity:
390  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
340.24g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
340.507g/mol
Monoisotopic Mass:
340.24g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.2  
Literature
Title Journal
Exploration of natural compounds as sources of new bifunctional scaffolds targeting cholinesterases and beta amyloid aggregation: the case of chelerythrine. Bioorganic & medicinal chemistry 20121115
Bis(2-hydroxy-3-tert-butyl-5-methyl-phenyl)-methane (bis-phenol) is a potent and selective inhibitor of the secretory pathway Ca²⁺ ATPase (SPCA1). Biochemical and biophysical research communications 20120803
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods. Journal of molecular graphics & modelling 20061101
Competitive sorption of pyrene on wood chars. Environmental science & technology 20060515
Male reproductive toxicity of four bisphenol antioxidants in mice and rats and their estrogenic effect. Archives of toxicology 20060401
Abnormal solvent effects on hydrogen atom abstraction. 3. Novel kinetics in sequential proton loss electron transfer chemistry. The Journal of organic chemistry 20051028
Secretory pathway Ca(2+)-ATPase (SPCA1) Ca(2)+ pumps, not SERCAs, regulate complex [Ca(2+)](i) signals in human spermatozoa. Journal of cell science 20050415
Novel lanthanide(II) complexes supported by carbon-bridged biphenolate ligands: synthesis, structure and catalytic activity. Dalton transactions (Cambridge, England : 2003) 20040321
Antioxidant activity of o-bisphenols: the role of intramolecular hydrogen bonding. The Journal of organic chemistry 20030627
Estrogenic activity of phenolic additives determined by an in vitro yeast bioassay. Environmental health perspectives 20010201
Properties