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Home Halogens 2-Methyl-5-nitro-6-chlorophenol

2-Methyl-5-nitro-6-chlorophenol

CAS No.:
39183-20-5
Catalog Number:
AG00762B
Molecular Formula:
C7H6ClNO3
Molecular Weight:
187.5804
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$13
- +
5g
95%
In Stock USA
United States
$19
- +
25g
95%
In Stock USA
United States
$50
- +
100g
95%
In Stock USA
United States
$150
- +
Product Description
Catalog Number:
AG00762B
Chemical Name:
2-Methyl-5-nitro-6-chlorophenol
CAS Number:
39183-20-5
Molecular Formula:
C7H6ClNO3
Molecular Weight:
187.5804
MDL Number:
MFCD03425888
IUPAC Name:
2-chloro-6-methyl-3-nitrophenol
InChI:
InChI=1S/C7H6ClNO3/c1-4-2-3-5(9(11)12)6(8)7(4)10/h2-3,10H,1H3
InChI Key:
FYPOFAFXSGYVLK-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(c(c1Cl)O)C
EC Number:
609-617-5
Properties
Complexity:
182  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.004g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
187.579g/mol
Monoisotopic Mass:
187.004g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Literature
Title Journal
Mutagenic activities of a chlorination by-product of butamifos, its structural isomer, and their related compounds. Chemosphere 20100101
Properties