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

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

CAS No.:
25889-37-6
Catalog Number:
AG006V7L
Molecular Formula:
C8H6F3NO3
Molecular Weight:
221.1333
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG006V7L
Chemical Name:
4-methoxy-2-nitro-1-(trifluoromethyl)benzene
CAS Number:
25889-37-6
Molecular Formula:
C8H6F3NO3
Molecular Weight:
221.1333
MDL Number:
MFCD11848539
IUPAC Name:
4-methoxy-2-nitro-1-(trifluoromethyl)benzene
InChI:
InChI=1S/C8H6F3NO3/c1-15-5-2-3-6(8(9,10)11)7(4-5)12(13)14/h2-4H,1H3
InChI Key:
KCOIUQMLFCNNAP-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)[N+](=O)[O-])C(F)(F)F
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