Home Other Building Blocks 1,1,1-Tris(4-hydroxyphenyl)ethane

1,1,1-Tris(4-hydroxyphenyl)ethane

CAS No.:
27955-94-8
Catalog Number:
AG003AZD
Molecular Formula:
C20H18O3
Molecular Weight:
306.3551
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$19
- +
100g
98%
In Stock USA
United States
$50
- +
Product Description
Catalog Number:
AG003AZD
Chemical Name:
1,1,1-Tris(4-hydroxyphenyl)ethane
CAS Number:
27955-94-8
Molecular Formula:
C20H18O3
Molecular Weight:
306.3551
MDL Number:
MFCD00012180
IUPAC Name:
4-[1,1-bis(4-hydroxyphenyl)ethyl]phenol
InChI:
InChI=1S/C20H18O3/c1-20(14-2-8-17(21)9-3-14,15-4-10-18(22)11-5-15)16-6-12-19(23)13-7-16/h2-13,21-23H,1H3
InChI Key:
BRPSWMCDEYMRPE-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)O)(c1ccc(cc1)O)c1ccc(cc1)O
UNII:
25K43J16E2
Properties
Complexity:
304  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.126g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
306.361g/mol
Monoisotopic Mass:
306.126g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
60.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  
Literature
Title Journal
Structure-based discovery of triphenylmethane derivatives as inhibitors of hepatitis C virus helicase. Journal of medicinal chemistry 20090514
Adducts of 1,1,1-tris(4-hydroxyphenyl)ethane with diamines: three-dimensional hydrogen-bonded frameworks formed with 1,6-diaminohexane and 2,2'-bipyridyl. Acta crystallographica. Section C, Crystal structure communications 20020401
Adducts of 1,1,1-tris(4-hydroxyphenyl)ethane with 1,2-bis(4-pyridyl)ethane and 1,2-bis(4-pyridyl)ethene: continuously interwoven structures in three dimensions. Acta crystallographica. Section C, Crystal structure communications 20020101
Fast and convenient divergent synthesis of aliphatic ester dendrimers by anhydride coupling. Journal of the American Chemical Society 20010627
Properties