1119-67-1 Purity
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Specification
The molecular formula of (Chloroethynyl)benzene is C8H5Cl.
The molecular weight of (Chloroethynyl)benzene is 136.58 g/mol.
The IUPAC name of (Chloroethynyl)benzene is 2-chloroethynylbenzene.
The InChI of (Chloroethynyl)benzene is InChI=1S/C8H5Cl/c9-7-6-8-4-2-1-3-5-8/h1-5H.
The InChIKey of (Chloroethynyl)benzene is GDWZLADUGAKASM-UHFFFAOYSA-N.
The canonical SMILES of (Chloroethynyl)benzene is C1=CC=C(C=C1)C#CCl.
The CAS number of (Chloroethynyl)benzene is 1483-82-5.
The XLogP3 value of (Chloroethynyl)benzene is 3.5.
There are 0 hydrogen bond donor counts in (Chloroethynyl)benzene.
There is 1 rotatable bond count in (Chloroethynyl)benzene.