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1417789-14-0 | Pyridine, 5-bromo-2-[(3R)-3-pyrrolidinyloxy]-, hydrochloride (1:1)
CAS No: 1417789-14-0 Catalog No: AG001H20 MDL No:MFCD22631749
Product Description
Catalog Number:
AG001H20
Chemical Name:
Pyridine, 5-bromo-2-[(3R)-3-pyrrolidinyloxy]-, hydrochloride (1:1)
CAS Number:
1417789-14-0
Molecular Formula:
C9H12BrClN2O
Molecular Weight:
279.5614
MDL Number:
MFCD22631749
IUPAC Name:
5-bromo-2-[(3R)-pyrrolidin-3-yl]oxypyridine;hydrochloride
InChI:
InChI=1S/C9H11BrN2O.ClH/c10-7-1-2-9(12-5-7)13-8-3-4-11-6-8;/h1-2,5,8,11H,3-4,6H2;1H/t8-;/m1./s1
InChI Key:
NCUGVVBYQVQFDJ-DDWIOCJRSA-N
SMILES:
Brc1ccc(nc1)O[C@H]1CNCC1.Cl
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
277.982g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
279.562g/mol
Monoisotopic Mass:
277.982g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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