4-chloro-3-iodocinnoline

4-chloro-3-iodocinnoline

CAS: 82452-99-1

Formula: C8H4ClIN2

SMILES: ClC1=C2C=CC=CC2=NN=C1I

IUPAC: 4-chloro-3-iodocinnoline

InChI: InChI=1S/C8H4ClIN2/c9-7-5-3-1-2-4-6(5)11-12-8(7)10/h1-4H

Composition: C (33.08%), H (1.39%), Cl (12.20%), I (43.69%), N (9.64%)

Molar Mass: 290.49

Atom Count: 16

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	289.91077
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	DEOSDIOOYNWSMJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.72
Topological Polar Surface Area	25.78
Polarizability	23.19
Ring Count	2
Rotatable Bond Count	0

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