Home Nitros 2-Methoxy-4-nitro-1-(trifluoromethyl)benzene

2-Methoxy-4-nitro-1-(trifluoromethyl)benzene

CAS No.:
453560-74-2
Catalog Number:
AG00DIYX
Molecular Formula:
C8H6F3NO3
Molecular Weight:
221.1333
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
1 week
United States
$292
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Product Description
Catalog Number:
AG00DIYX
Chemical Name:
2-Methoxy-4-nitro-1-(trifluoromethyl)benzene
CAS Number:
453560-74-2
Molecular Formula:
C8H6F3NO3
Molecular Weight:
221.1333
MDL Number:
MFCD04112485
IUPAC Name:
2-methoxy-4-nitro-1-(trifluoromethyl)benzene
InChI:
InChI=1S/C8H6F3NO3/c1-15-7-4-5(12(13)14)2-3-6(7)8(9,10)11/h2-4H,1H3
InChI Key:
UDEARCRKLPPYAU-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1C(F)(F)F)[N+](=O)[O-]
Properties
Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.03g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.135g/mol
Monoisotopic Mass:
221.03g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties