CAS
13187-99-0 Purity
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13187-99-0 Purity
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Specification
The molecular formula is C9H11Br.
The molecular weight is 199.09 g/mol.
The IUPAC name is 1-(2-bromoethyl)-2-methylbenzene.
The InChI is InChI=1S/C9H11Br/c1-8-4-2-3-5-9(8)6-7-10/h2-5H,6-7H2,1H3.
The InChIKey is PZXWZXNXBNIAHO-UHFFFAOYSA-N.
The canonical SMILES is CC1=CC=CC=C1CCBr.
The CAS number is 16793-90-1.
The EC number is 627-489-9.
The DSSTox Substance ID is DTXSID60373661.
No, 2-Methylphenethyl bromide has a formal charge of 0.