98434-06-1 Purity
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Specification
The molecular formula is C8H3ClI2N2.
It was created on October 30, 2011.
The IUPAC name is 4-chloro-6,8-diiodoquinazoline.
The InChI is InChI=1S/C8H3ClI2N2/c9-8-5-1-4(10)2-6(11)7(5)12-3-13-8/h1-3H.
The InChIKey is KPPIHYTZNJIYNY-UHFFFAOYSA-N.
The canonical SMILES is C1=C(C=C(C2=C1C(=NC=N2)Cl)I)I.
The CAS number is 98436-53-4.
The molecular weight is 416.38 g/mol.
The XLogP3-AA value is 3.8.
Quinazoline,4-chloro-6,8-diiodo has 2 hydrogen bond acceptors.