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1-{2H-pyrazolo[3,4-b]pyridin-3-yl}methanamine dihydrochloride

1-{2H-pyrazolo[3,4-b]pyridin-3-yl}methanamine dihydrochloride

CAS: 2169998-44-9

Formula: C7H10Cl2N4

SMILES: Cl.Cl.NCC1=C2C=CC=NC2=NN1

IUPAC: 1-{2H-pyrazolo[3,4-b]pyridin-3-yl}methanamine dihydrochloride

InChI: InChI=1S/C7H8N4.2ClH/c8-4-6-5-2-1-3-9-7(5)11-10-6;;/h1-3H,4,8H2,(H,9,10,11);2*1H

Composition: C (38.03%), H (4.56%), Cl (32.07%), N (25.34%)

Molar Mass: 221.09

Atom Count: 23

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 220.0282517
Formal Charge 0
FSP3 0.14
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey WNNMOQLDBPOIRB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 43.59
Topological Polar Surface Area 67.59
Polarizability 16.46
Ring Count 2
Rotatable Bond Count 1

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Key Organics Ltd
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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 2169998-44-9 $634.74-$2,273.49$634.74$634.74$2,273.49$2,273.49
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ChemBridge Corp.
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95% <4 Days 2169998-44-9 $215.05-$2,466.75$215.05$936.10$2,466.75
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