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Home Other Building Blocks 2,4-Di-tert-pentylphenol

2,4-Di-tert-pentylphenol

CAS No.:
120-95-6
Catalog Number:
AG000Q1C
Molecular Formula:
C16H26O
Molecular Weight:
234.3770
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
95%
In Stock USA
United States
$33
- +
25g
95%
In Stock USA
United States
$47
- +
100g
95%
In Stock USA
United States
$86
- +
Product Description
Catalog Number:
AG000Q1C
Chemical Name:
2,4-Di-tert-pentylphenol
CAS Number:
120-95-6
Molecular Formula:
C16H26O
Molecular Weight:
234.3770
MDL Number:
MFCD00041929
IUPAC Name:
2,4-bis(2-methylbutan-2-yl)phenol
InChI:
InChI=1S/C16H26O/c1-7-15(3,4)12-9-10-14(17)13(11-12)16(5,6)8-2/h9-11,17H,7-8H2,1-6H3
InChI Key:
WMVJWKURWRGJCI-UHFFFAOYSA-N
SMILES:
CCC(c1ccc(c(c1)C(CC)(C)C)O)(C)C
EC Number:
204-439-0
UNII:
852F1HP88H
NSC Number:
158351
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.198g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
234.383g/mol
Monoisotopic Mass:
234.198g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6  
Literature
Title Journal
[Determination of 2,4,6-tri-tert-butylphenol and related compounds in foods]. Shokuhin eiseigaku zasshi. Journal of the Food Hygienic Society of Japan 20011201
Properties