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1-[3-(pyridin-2-yl)-1,2-oxazol-5-yl]methanamine dihydrochloride

1-[3-(pyridin-2-yl)-1,2-oxazol-5-yl]methanamine dihydrochloride

CAS: 1609400-00-1

Formula: C9H11Cl2N3O

SMILES: Cl.Cl.NCC1=CC(=NO1)C1=NC=CC=C1

IUPAC: 1-[3-(pyridin-2-yl)-1,2-oxazol-5-yl]methanamine dihydrochloride

InChI: InChI=1S/C9H9N3O.2ClH/c10-6-7-5-9(12-13-7)8-3-1-2-4-11-8;;/h1-5H,6,10H2;2*1H

Composition: C (43.57%), H (4.47%), Cl (28.58%), N (16.94%), O (6.45%)

Molar Mass: 248.11

Atom Count: 26

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 247.0279174
Formal Charge 0
FSP3 0.11
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey XXJBJYTYWQRRLJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 48.09
Topological Polar Surface Area 64.94
Polarizability 19.74
Ring Count 2
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
95% <4 Days 1609400-00-1 $215.05-$2,466.75$215.05$708.40$2,466.75
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