Products 96989-76-3

CAS 96989-76-3 appears in our catalog under these names: Acebrophylline, trans-4-[[(2-Amino-3,5-dibromophenyl)methyl]amino]cyclohexanol 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetate, 95%, 95%, Ambroxol (acefylline). Offered by: Chemat Brand, Biosynth, Chemat, MedChemExpress. Available pack sizes: on request, 0,25g, 0,1g, 0,5g, 1g, 2g, 100mg, 250mg.

Structural formula: {0} (CAS {1})

4-[(2-amino-3,5-dibromophenyl)methylamino]cyclohexan-1-ol;2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetic acid (CAS 96989-76-3) is a chemical compound with the molecular formula C22H28Br2N6O5 and a molecular weight of 616.3 g/mol. IUPAC name: 4-[(2-amino-3,5-dibromophenyl)methylamino]cyclohexan-1-ol;2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetic acid. InChIKey: IPUHJDQWESJTGD-UHFFFAOYSA-N.

Identity
Molecular formulaC22H28Br2N6O5
Molecular weight616.3 g/mol
IUPAC name4-[(2-amino-3,5-dibromophenyl)methylamino]cyclohexan-1-ol;2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetic acid
InChIKeyIPUHJDQWESJTGD-UHFFFAOYSA-N
SMILESCN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)O.C1CC(CCC1NCC2=C(C(=CC(=C2)Br)Br)N)O

Computed by PubChem (NCBI)