64248-58-4 Purity
98%
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Specification
The molecular formula of 4-Chlorophenethyl bromide is C8H8BrCl.
The molecular weight of 4-Chlorophenethyl bromide is 219.50 g/mol.
The IUPAC name of 4-Chlorophenethyl bromide is 1-(2-bromoethyl)-4-chlorobenzene.
The InChI of 4-Chlorophenethyl bromide is InChI=1S/C8H8BrCl/c9-6-5-7-1-3-8(10)4-2-7/h1-4H,5-6H2.
The InChIKey of 4-Chlorophenethyl bromide is YAFMYKFAUNCQPU-UHFFFAOYSA-N.
The canonical SMILES of 4-Chlorophenethyl bromide is C1=CC(=CC=C1CCBr)Cl.
The CAS number of 4-Chlorophenethyl bromide is 6529-53-9.
4-Chlorophenethyl bromide has 2 rotatable bonds.
Yes, 4-Chlorophenethyl bromide is a canonicalized compound.
The topological polar surface area of 4-Chlorophenethyl bromide is 0Ų.