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Home > Fluorides > 1260770-16-8
1260770-16-8 | Benzene, 4-methoxy-1-nitro-2-(trifluoromethoxy)-
CAS No: 1260770-16-8 Catalog No: AG000R6G MDL No:
Product Description
Catalog Number:
AG000R6G
Chemical Name:
Benzene, 4-methoxy-1-nitro-2-(trifluoromethoxy)-
CAS Number:
1260770-16-8
Molecular Formula:
C8H6F3NO4
Molecular Weight:
237.1327
IUPAC Name:
4-methoxy-1-nitro-2-(trifluoromethoxy)benzene
InChI:
InChI=1S/C8H6F3NO4/c1-15-5-2-3-6(12(13)14)7(4-5)16-8(9,10)11/h2-4H,1H3
InChI Key:
JSIYUZKPIAIKCO-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)OC(F)(F)F)[N+](=O)[O-]
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.025g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.134g/mol
Monoisotopic Mass:
237.025g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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