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Home > Nitro Compounds > 1286207-32-6
1286207-32-6 | (S)-3-Nitro-2-(pyrrolidin-3-yloxy)pyridine hydrochloride
CAS No: 1286207-32-6 Catalog No: AG01ERO3 MDL No:
Product Description
Catalog Number:
AG01ERO3
Chemical Name:
(S)-3-Nitro-2-(pyrrolidin-3-yloxy)pyridine hydrochloride
CAS Number:
1286207-32-6
Molecular Formula:
C9H12ClN3O3
Molecular Weight:
245.6629
IUPAC Name:
3-nitro-2-[(3S)-pyrrolidin-3-yl]oxypyridine;hydrochloride
InChI:
InChI=1S/C9H11N3O3.ClH/c13-12(14)8-2-1-4-11-9(8)15-7-3-5-10-6-7;/h1-2,4,7,10H,3,5-6H2;1H/t7-;/m0./s1
InChI Key:
BIRWQHLYSQIAQQ-FJXQXJEOSA-N
SMILES:
[O-][N+](=O)c1cccnc1O[C@@H]1CNCC1.Cl
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
245.057g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
245.663g/mol
Monoisotopic Mass:
245.057g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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