CAS
99981-13-2 Purity
96%
99981-13-2 Purity
96%
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Specification
The molecular formula is C11H10BrNS.
The molecular weight is 268.17 g/mol.
It was created on 2011-10-30.
The IUPAC Name is 2-Bromo-4-(4-ethylphenyl)-1,3-thiazole.
The Canonical SMILES is CCC1=CC=C(C=C1)C2=CSC(=N2)Br.
The CAS number is 99983-39-8.
It has 2 hydrogen bond acceptor counts.
The topological polar surface area is 41.1 Ų.
The formal charge is 0.
Yes, the compound is canonicalized.