200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 86604-79-7
86604-79-7 | 4-Nitro-2,3,5-trimethylpyridine N-oxide
CAS No: 86604-79-7 Catalog No: AG0036C5 MDL No:MFCD00800254
Product Description
Catalog Number:
AG0036C5
Chemical Name:
4-Nitro-2,3,5-trimethylpyridine N-oxide
CAS Number:
86604-79-7
Molecular Formula:
C8H10N2O3
Molecular Weight:
182.1766
MDL Number:
MFCD00800254
IUPAC Name:
2,3,5-trimethyl-4-nitro-1-oxidopyridin-1-ium
InChI:
InChI=1S/C8H10N2O3/c1-5-4-9(11)7(3)6(2)8(5)10(12)13/h4H,1-3H3
InChI Key:
YMBLTOGTYNFTRX-UHFFFAOYSA-N
SMILES:
Cc1[n+]([O-])cc(c(c1C)[N+](=O)[O-])C
EC Number:
617-893-3
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.069g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.179g/mol
Monoisotopic Mass:
182.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
71.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.