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Home Other Building Blocks 2,5-Di-tert-butylphenol

2,5-Di-tert-butylphenol

CAS No.:
5875-45-6
Catalog Number:
AG00ECU2
Molecular Formula:
Molecular Weight:
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
500mg
95%
In Stock USA
United States
$280
- +
1g
95%
In Stock USA
United States
$433
- +
Product Description
Catalog Number:
AG00ECU2
Chemical Name:
2,5-Di-tert-butylphenol
CAS Number:
5875-45-6
MDL Number:
MFCD00233163
IUPAC Name:
2,5-ditert-butylphenol
InChI:
InChI=1S/C14H22O/c1-13(2,3)10-7-8-11(12(15)9-10)14(4,5)6/h7-9,15H,1-6H3
InChI Key:
KDBZVULQVCUNNA-UHFFFAOYSA-N
EC Number:
227-543-8
UNII:
R9R0A277K1
NSC Number:
68767
Properties
Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.167g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
206.329g/mol
Monoisotopic Mass:
206.167g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9  
Literature
Title Journal
Discovery of novel SERCA inhibitors by virtual screening of a large compound library. European journal of medicinal chemistry 20110501
Properties