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Home Nitros 1-(Trifluoroethoxy)-2-methyl-4-nitrobenzene

1-(Trifluoroethoxy)-2-methyl-4-nitrobenzene

CAS No.:
96308-26-8
Catalog Number:
AG00IJSQ
Molecular Formula:
C9H8F3NO3
Molecular Weight:
235.1599
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$254
- +
Product Description
Catalog Number:
AG00IJSQ
Chemical Name:
1-(Trifluoroethoxy)-2-methyl-4-nitrobenzene
CAS Number:
96308-26-8
Molecular Formula:
C9H8F3NO3
Molecular Weight:
235.1599
MDL Number:
MFCD27935093
IUPAC Name:
2-methyl-4-nitro-1-(2,2,2-trifluoroethoxy)benzene
InChI:
InChI=1S/C9H8F3NO3/c1-6-4-7(13(14)15)2-3-8(6)16-5-9(10,11)12/h2-4H,5H2,1H3
InChI Key:
DKPXOGKKLKMSFR-UHFFFAOYSA-N
SMILES:
Cc1cc(ccc1OCC(F)(F)F)[N+](=O)[O-]
Properties
Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.046g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.162g/mol
Monoisotopic Mass:
235.046g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties