914223-10-2 Purity
96%
If you have any other questions or need other size, please get a quote.
Specification
The molecular formula is C9H9BrN2O3.
The synonyms are N-(4-BROMO-5-METHYL-6-NITROPHENYL)ACETAMIDE and N-(4-bromo-3-methyl-2-nitrophenyl)acetamide.
The molecular weight is 273.08 g/mol.
The IUPAC name is N-(4-bromo-3-methyl-2-nitrophenyl)acetamide.
The InChI code is InChI=1S/C9H9BrN2O3/c1-5-7(10)3-4-8(11-6(2)13)9(5)12(14)15/h3-4H,1-2H3,(H,11,13).
The InChIKey is IXAMFCDBXQSERN-UHFFFAOYSA-N.
The Canonical SMILES is CC1=C(C=CC(=C1[N+](=O)[O-])NC(=O)C)Br.
The XLogP3 value is 2.5.
The compound has 1 hydrogen bond donor count and 3 hydrogen bond acceptor counts.
The topological polar surface area is 74.9 ?2.