Products 68238-36-8

CAS 68238-36-8 appears in our catalog under these names: Isosulfan Blue, Isosulfan blue/ 100%, Isosulfan blue, Isosulfan blue 99%, Isosulfan Blue, 99%, 99%. Offered by: Chemat Brand, TRC, TargetMol, GLPBio, Biosynth. Available pack sizes: on request, 100mg, 10mg, 1mg, 5mg, 25mg, 50mg, 200mg.

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

Sodium 2-[[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)methyl]benzene-1,4-disulfonate (CAS 68238-36-8) is a chemical compound with the molecular formula C27H31N2NaO6S2 and a molecular weight of 566.7 g/mol. IUPAC name: sodium 2-[[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)methyl]benzene-1,4-disulfonate. InChIKey: NLUFDZBOHMOBOE-UHFFFAOYSA-M.

Identity
Molecular formulaC27H31N2NaO6S2
Molecular weight566.7 g/mol
IUPAC namesodium 2-[[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)methyl]benzene-1,4-disulfonate
InChIKeyNLUFDZBOHMOBOE-UHFFFAOYSA-M
SMILESCCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=C(C=CC(=C3)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+]

Computed by PubChem (NCBI)