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Home > Nitro Compounds > 217302-90-4
217302-90-4 | Pyridine, 5-nitro-2-propyl-
CAS No: 217302-90-4 Catalog No: AG01FFF3 MDL No:
Product Description
Catalog Number:
AG01FFF3
Chemical Name:
Pyridine, 5-nitro-2-propyl-
CAS Number:
217302-90-4
Molecular Formula:
C8H10N2O2
Molecular Weight:
166.1772
IUPAC Name:
5-nitro-2-propylpyridine
InChI:
InChI=1S/C8H10N2O2/c1-2-3-7-4-5-8(6-9-7)10(11)12/h4-6H,2-3H2,1H3
InChI Key:
YRBQOPXFQBEXDD-UHFFFAOYSA-N
SMILES:
CCCc1ccc(cn1)[N+](=O)[O-]
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.074g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.18g/mol
Monoisotopic Mass:
166.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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