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6-(chloromethyl)-1H-pyrrolo[2,3-b]pyridine

6-(chloromethyl)-1H-pyrrolo[2,3-b]pyridine

CAS: 1559059-81-2

Formula: C8H7ClN2

SMILES: ClCC1=CC=C2C=CNC2=N1

IUPAC: 6-(chloromethyl)-1H-pyrrolo[2,3-b]pyridine

InChI: InChI=1S/C8H7ClN2/c9-5-7-2-1-6-3-4-10-8(6)11-7/h1-4H,5H2,(H,10,11)

Composition: C (57.67%), H (4.24%), Cl (21.28%), N (16.81%)

Molar Mass: 166.61

Atom Count: 18

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 166.0297759
Formal Charge 0
FSP3 0.12
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey VDJZAHDFLSNLGB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 44.28
Topological Polar Surface Area 28.68
Polarizability 17.63
Ring Count 2
Rotatable Bond Count 1

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