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7-iodo-5H-pyrrolo[2,3-b]pyrazine

7-iodo-5H-pyrrolo[2,3-b]pyrazine

CAS: 889451-26-7

Formula: C6H4IN3

SMILES: IC1=CNC2=NC=CN=C12

IUPAC: 7-iodo-5H-pyrrolo[2,3-b]pyrazine

InChI: InChI=1S/C6H4IN3/c7-4-3-10-6-5(4)8-1-2-9-6/h1-3H,(H,9,10)

Composition: C (29.41%), H (1.65%), I (51.79%), N (17.15%)

Molar Mass: 245.023

Atom Count: 14

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 244.94499
Formal Charge 0
FSP3 0
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey YGZUTCSWHPWNMC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 45.77
Topological Polar Surface Area 41.57
Polarizability 18.33
Ring Count 2
Rotatable Bond Count 0

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Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 889451-26-7 $116.01-$336.69$116.01$336.69
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