Home Nitros Pyridine, 4-methoxy-5-nitro-2-(trifluoromethyl)-

Pyridine, 4-methoxy-5-nitro-2-(trifluoromethyl)-

CAS No.:
1588441-18-2
Catalog Number:
AG001QXO
Molecular Formula:
C7H5F3N2O3
Molecular Weight:
222.1214
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Product Description
Catalog Number:
AG001QXO
Chemical Name:
Pyridine, 4-methoxy-5-nitro-2-(trifluoromethyl)-
CAS Number:
1588441-18-2
Molecular Formula:
C7H5F3N2O3
Molecular Weight:
222.1214
MDL Number:
MFCD26383920
IUPAC Name:
4-methoxy-5-nitro-2-(trifluoromethyl)pyridine
InChI:
InChI=1S/C7H5F3N2O3/c1-15-5-2-6(7(8,9)10)11-3-4(5)12(13)14/h2-3H,1H3
InChI Key:
HEKASLCSFSEZAP-UHFFFAOYSA-N
SMILES:
COc1cc(ncc1[N+](=O)[O-])C(F)(F)F
Properties
Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.025g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.123g/mol
Monoisotopic Mass:
222.025g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
67.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties