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136888-21-6 | Pyridine, 2-chloro-5-fluoro-3-nitro-
CAS No: 136888-21-6 Catalog No: AG0012IR MDL No:MFCD06659490
Product Description
Catalog Number:
AG0012IR
Chemical Name:
Pyridine, 2-chloro-5-fluoro-3-nitro-
CAS Number:
136888-21-6
Molecular Formula:
C5H2ClFN2O2
Molecular Weight:
176.5330
MDL Number:
MFCD06659490
IUPAC Name:
2-chloro-5-fluoro-3-nitropyridine
InChI:
InChI=1S/C5H2ClFN2O2/c6-5-4(9(10)11)1-3(7)2-8-5/h1-2H
InChI Key:
SVVZGNAZMPSGMU-UHFFFAOYSA-N
SMILES:
Fc1cnc(c(c1)[N+](=O)[O-])Cl
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.979g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.531g/mol
Monoisotopic Mass:
175.979g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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