2-chloro-N-(2,4,6-triiodophenyl)acetamide

2-chloro-N-(2,4,6-triiodophenyl)acetamide

CAS: 380346-57-6

Formula: C8H5ClI3NO

SMILES: ClCC(=O)NC1=C(I)C=C(I)C=C1I

IUPAC: 2-chloro-N-(2,4,6-triiodophenyl)acetamide

InChI: InChI=1S/C8H5ClI3NO/c9-3-7(14)13-8-5(11)1-4(10)2-6(8)12/h1-2H,3H2,(H,13,14)

Composition: C (17.56%), H (0.92%), Cl (6.48%), I (69.56%), N (2.56%), O (2.92%)

Molar Mass: 547.3

Atom Count: 19

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	546.71938
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	BXOOUGCJGVOZHY-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	85.76
Topological Polar Surface Area	29.1
Polarizability	33.45
Ring Count	1
Rotatable Bond Count	2

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