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1020253-22-8 | Pyridine, 5-bromo-3-nitro-2-(1-pyrrolidinyl)-
CAS No: 1020253-22-8 Catalog No: AG0006E3 MDL No:MFCD09972197
Product Description
Catalog Number:
AG0006E3
Chemical Name:
Pyridine, 5-bromo-3-nitro-2-(1-pyrrolidinyl)-
CAS Number:
1020253-22-8
Molecular Formula:
C9H10BrN3O2
Molecular Weight:
272.0986
MDL Number:
MFCD09972197
IUPAC Name:
5-bromo-3-nitro-2-pyrrolidin-3-ylpyridine
InChI:
InChI=1S/C9H10BrN3O2/c10-7-3-8(13(14)15)9(12-5-7)6-1-2-11-4-6/h3,5-6,11H,1-2,4H2
InChI Key:
YXSSIQVKYYTXGR-UHFFFAOYSA-N
SMILES:
Brc1cnc(c(c1)[N+](=O)[O-])N1CCCC1
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.996g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
272.102g/mol
Monoisotopic Mass:
270.996g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
70.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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