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Home > Nitro Compounds > 76211-92-2
76211-92-2 | 2-(3,5-dimethyl-1H-pyrazol-1-yl)-5-nitropyridine
CAS No: 76211-92-2 Catalog No: AG00ISAX MDL No:MFCD02102602
Product Description
Catalog Number:
AG00ISAX
Chemical Name:
2-(3,5-dimethyl-1H-pyrazol-1-yl)-5-nitropyridine
CAS Number:
76211-92-2
Molecular Formula:
C10H10N4O2
Molecular Weight:
218.2120
MDL Number:
MFCD02102602
IUPAC Name:
2-(3,5-dimethylpyrazol-1-yl)-5-nitropyridine
InChI:
InChI=1S/C10H10N4O2/c1-7-5-8(2)13(12-7)10-4-3-9(6-11-10)14(15)16/h3-6H,1-2H3
InChI Key:
HZNRYZPDTGPQPQ-UHFFFAOYSA-N
SMILES:
Cc1nn(c(c1)C)c1ccc(cn1)[N+](=O)[O-]
NSC Number:
270442
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.08g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.216g/mol
Monoisotopic Mass:
218.08g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
76.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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