IR 813 (tosylate), 98%

cas: 134127-48-3 — see every product listed under this CAS number, including other names

IR 813 (tosylate), 98% (CAS 134127-48-3) is a chemical reagent available from Chemat. Available pack sizes: 1g, 5g, 25g. Offered by: Fluorochem.

brandFluorochem
catalog numberF555098-1G
cas134127-48-3
size1g
availability In Stock China
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Available pack sizes

brand size price
Fluorochem 1g 174.96 Pln
Fluorochem 5g 622.72 Pln
Fluorochem 25g 2075.33 Pln

properties

purity98%
dual useNo
currencyEUR
delivery time2-3 weeks
categoryOdczynniki chemiczne
Structural formula: {0} (CAS {1})

(2E)-2-[(2E)-2-[2-chloro-3-[(E)-2-(1,1,3-trimethylbenzo[e]indol-3-ium-2-yl)ethenyl]cyclohex-2-en-1-ylidene]ethylidene]-1,1,3-trimethylbenzo[e]indole;4-methylbenzenesulfonate (CAS 134127-48-3) is a chemical compound with the molecular formula C47H47ClN2O3S and a molecular weight of 755.4 g/mol. IUPAC name: (2E)-2-[(2E)-2-[2-chloro-3-[(E)-2-(1,1,3-trimethylbenzo[e]indol-3-ium-2-yl)ethenyl]cyclohex-2-en-1-ylidene]ethylidene]-1,1,3-trimethylbenzo[e]indole;4-methylbenzenesulfonate. InChIKey: LQVQHHTYXSPHSQ-UHFFFAOYSA-M.

Identity
Molecular formulaC47H47ClN2O3S
Molecular weight755.4 g/mol
IUPAC name(2E)-2-[(2E)-2-[2-chloro-3-[(E)-2-(1,1,3-trimethylbenzo[e]indol-3-ium-2-yl)ethenyl]cyclohex-2-en-1-ylidene]ethylidene]-1,1,3-trimethylbenzo[e]indole;4-methylbenzenesulfonate
InChIKeyLQVQHHTYXSPHSQ-UHFFFAOYSA-M
SMILESCC1=CC=C(C=C1)S(=O)(=O)[O-].CC1(C(=[N+](C2=C1C3=CC=CC=C3C=C2)C)/C=C/C4=C(/C(=C/C=C/5\C(C6=C(N5C)C=CC7=CC=CC=C76)(C)C)/CCC4)Cl)C

Computed by PubChem (NCBI)

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