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1-iodoisoquinoline

1-iodoisoquinoline

CAS: 19658-77-6

Formula: C9H6IN

SMILES: IC1=NC=CC2=CC=CC=C12

IUPAC: 1-iodoisoquinoline

InChI: InChI=1S/C9H6IN/c10-9-8-4-2-1-3-7(8)5-6-11-9/h1-6H

Composition: C (42.38%), H (2.37%), I (49.76%), N (5.49%)

Molar Mass: 255.058

Atom Count: 17

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 254.95449
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey FDDBUIWRNBGXHB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 53.42
Topological Polar Surface Area 12.89
Polarizability 22
Ring Count 2
Rotatable Bond Count 0

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