IR-825, 98.27%

cas: 1558079-49-4 — see every product listed under this CAS number, including other names

IR-825, 98.27% (CAS 1558079-49-4) is a chemical reagent available from Chemat. Available pack sizes: 5 mg, 100 mg, 10 mg, 50 mg, 25 mg. Offered by: MedChemExpress.

brandMedChemExpress
catalog numberHY-118924-5 mg
cas1558079-49-4
size5 mg
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Available pack sizes

brand size price
MedChemExpress 5 mg 1271.71 Pln
MedChemExpress 100 mg 6259.37 Pln
MedChemExpress 10 mg 1968.31 Pln
MedChemExpress 50 mg 4531.80 Pln
MedChemExpress 25 mg 3068.94 Pln

properties

delivery time over 3 weeks
purity98.27%

4-[[2-[2-[3-[2-[3-[(4-carboxyphenyl)methyl]-1,1-dimethylbenzo[e]indol-3-ium-2-yl]ethenyl]-2-chlorocyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]methyl]benzoic acid (CAS 1558079-49-4) is a chemical compound with the molecular formula C54H48ClN2O4+ and a molecular weight of 824.4 g/mol. IUPAC name: 4-[[2-[2-[3-[2-[3-[(4-carboxyphenyl)methyl]-1,1-dimethylbenzo[e]indol-3-ium-2-yl]ethenyl]-2-chlorocyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]methyl]benzoic acid. InChIKey: SPEHNGMUCASLRM-UHFFFAOYSA-O.

Identity
Molecular formulaC54H48ClN2O4+
Molecular weight824.4 g/mol
IUPAC name4-[[2-[2-[3-[2-[3-[(4-carboxyphenyl)methyl]-1,1-dimethylbenzo[e]indol-3-ium-2-yl]ethenyl]-2-chlorocyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]methyl]benzoic acid
InChIKeySPEHNGMUCASLRM-UHFFFAOYSA-O
SMILESCC1(C(=[N+](C2=C1C3=CC=CC=C3C=C2)CC4=CC=C(C=C4)C(=O)O)C=CC5=C(C(=CC=C6C(C7=C(N6CC8=CC=C(C=C8)C(=O)O)C=CC9=CC=CC=C97)(C)C)CCC5)Cl)C

Computed by PubChem (NCBI)

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