54077-16-6 Purity
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Specification
The molecular formula is C11H12BrN.
The synonyms are 5-BROMO-2,3,3-TRIMETHYL-3H-INDOLE, 54136-24-2, 2,3,3-TRIMETHYL-5-BROMO-3H-INDOLE, 5-BROMO-2,3,3-TRIMETHYLINDOLE, and MFCD07779490.
The molecular weight is 238.12 g/mol.
It was created on October 26, 2006.
It was last modified on October 21, 2023.
The IUPAC name is 5-bromo-2,3,3-trimethylindole.
The InChI is InChI=1S/C11H12BrN/c1-7-11(2,3)9-6-8(12)4-5-10(9)13-7/h4-6H,1-3H3.
The InChIKey is OUWLZEOAVCFTAQ-UHFFFAOYSA-N.
The Canonical SMILES is CC1=NC2=C(C1(C)C)C=C(C=C2)Br.
The CAS number is 54136-24-2.