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Home Nitros 2,6-dimethyl-4-nitrophenol

2,6-dimethyl-4-nitrophenol

CAS No.:
2423-71-4
Catalog Number:
AG003G5I
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$50
- +
5g
97%
In Stock USA
United States
$94
- +
25g
97%
In Stock USA
United States
$300
- +
Product Description
Catalog Number:
AG003G5I
Chemical Name:
2,6-dimethyl-4-nitrophenol
CAS Number:
2423-71-4
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
MDL Number:
MFCD00007339
IUPAC Name:
2,6-dimethyl-4-nitrophenol
InChI:
InChI=1S/C8H9NO3/c1-5-3-7(9(11)12)4-6(2)8(5)10/h3-4,10H,1-2H3
InChI Key:
FNORUNUDZNWQFF-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(C)c(c(c1)C)O
EC Number:
219-353-9
NSC Number:
2990
Properties
Complexity:
166  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.058g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
167.164g/mol
Monoisotopic Mass:
167.058g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Literature
Title Journal
Kinetics and mechanism of 2,6-dimethyl-aniline degradation by hydroxyl radicals. Journal of hazardous materials 20091230
Solvation of nitrophenol isomers: consequences for solute electronic structure and alkane/water partitioning. The journal of physical chemistry. B 20090122
Identification of estrogenic/anti-estrogenic compounds in diesel exhaust particulate extract. Biomedical chromatography : BMC 20071101
Properties