82878-62-4 Purity
96%
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Specification
The molecular formula of 1-Chloro-4-iodobutane is C4H8ClI.
The molecular weight of 1-Chloro-4-iodobutane is 218.46 g/mol.
The IUPAC name of 1-Chloro-4-iodobutane is 1-chloro-4-iodobutane.
The InChI of 1-Chloro-4-iodobutane is InChI=1S/C4H8ClI/c5-3-1-2-4-6/h1-4H2.
The InChIKey of 1-Chloro-4-iodobutane is JXOSPTBRSOYXGC-UHFFFAOYSA-N.
The Canonical SMILES of 1-Chloro-4-iodobutane is C(CCI)CCl.
The CAS number of 1-Chloro-4-iodobutane is 10297-05-9.
1-Chloro-4-iodobutane has 0 hydrogen bond donor counts.
1-Chloro-4-iodobutane has 3 rotatable bond counts.
Yes, 1-Chloro-4-iodobutane is a canonicalized compound.