Products 1803099-44-6

CAS 1803099-44-6 appears in our catalog under these names: Cyanine7.5 carboxylic acid, 95%, Cyanine7·5 carboxylic acid, Cyanine7.5 carboxylic acid (chloride). Offered by: Lumiprobe, GLPBio, MedChemExpress. Available pack sizes: 1mg, 5mg, 25mg, 50mg, 100mg, 10 mg, 5 mg.

6-[1,1-dimethyl-2-[2-[3-[2-(1,1,3-trimethylbenzo[e]indol-3-ium-2-yl)ethenyl]cyclohex-2-en-1-ylidene]ethylidene]benzo[e]indol-3-yl]hexanoic acid chloride (CAS 1803099-44-6) is a chemical compound with the molecular formula C45H49ClN2O2 and a molecular weight of 685.3 g/mol. IUPAC name: 6-[1,1-dimethyl-2-[2-[3-[2-(1,1,3-trimethylbenzo[e]indol-3-ium-2-yl)ethenyl]cyclohex-2-en-1-ylidene]ethylidene]benzo[e]indol-3-yl]hexanoic acid chloride. InChIKey: NENPZWGBKUDTPW-UHFFFAOYSA-N.

Identity
Molecular formulaC45H49ClN2O2
Molecular weight685.3 g/mol
IUPAC name6-[1,1-dimethyl-2-[2-[3-[2-(1,1,3-trimethylbenzo[e]indol-3-ium-2-yl)ethenyl]cyclohex-2-en-1-ylidene]ethylidene]benzo[e]indol-3-yl]hexanoic acid chloride
InChIKeyNENPZWGBKUDTPW-UHFFFAOYSA-N
SMILESCC1(C(=[N+](C2=C1C3=CC=CC=C3C=C2)C)C=CC4=CC(=CC=C5C(C6=C(N5CCCCCC(=O)O)C=CC7=CC=CC=C76)(C)C)CCC4)C.[Cl-]

Computed by PubChem (NCBI)