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3-bromo-5-[(2S)-pyrrolidin-2-yl]pyridine dihydrochloride

3-bromo-5-[(2S)-pyrrolidin-2-yl]pyridine dihydrochloride

Formula: C9H13BrCl2N2

SMILES: Cl.Cl.BrC1=CN=CC(=C1)[C@@H]1CCCN1

IUPAC: 3-bromo-5-[(2S)-pyrrolidin-2-yl]pyridine dihydrochloride

InChI: InChI=1S/C9H11BrN2.2ClH/c10-8-4-7(5-11-6-8)9-2-1-3-12-9;;/h4-6,9,12H,1-3H2;2*1H/t9-;;/m0../s1

Composition: C (36.03%), H (4.37%), Br (26.63%), Cl (23.63%), N (9.34%)

Molar Mass: 300.02

Atom Count: 27

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 297.963917
Formal Charge 0
FSP3 0.44
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey NKWKVIGNLVWUBT-WWPIYYJJSA-N
Lipinski's Rule of Five 1
Molar Refractivity 51.98
Topological Polar Surface Area 24.92
Polarizability 20.35
Ring Count 2
Rotatable Bond Count 1

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Purity LeadTime Formula PacketSize UnitPrice
96% <7 Days C9H13BrCl2N2 $245.91-$816.26$245.91$492.75$816.26
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J&W PHARMLAB LLC
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Purity LeadTime Formula PacketSize UnitPrice
96% <2 Days C9H13BrCl2N2 $286.35-$6,762.00$286.35$457.70$687.70$1,127.00$1,817.00$6,762.00
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