I4.05

cas: 312289-90-0 — see every product listed under this CAS number, including other names

I4.05 (CAS 312289-90-0) is a chemical reagent available from Chemat. Available pack sizes: 25MG, 5MG. Offered by: Sigma-Aldrich.

brandSigma-Aldrich
catalog numberSML4207-25MG
cas312289-90-0
size25MG
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Available pack sizes

brand size price
Sigma-Aldrich 25MG 1810.00 Pln
Sigma-Aldrich 5MG 486.00 Pln
Structural formula: {0} (CAS {1})

2-chloro-5-[5-[(E)-[1-(4-fluorophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl]furan-2-yl]benzoic acid (CAS 312289-90-0) is a chemical compound with the molecular formula C21H12ClFN2O5 and a molecular weight of 426.8 g/mol. IUPAC name: 2-chloro-5-[5-[(E)-[1-(4-fluorophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl]furan-2-yl]benzoic acid. InChIKey: CQLKMZCZYWHROC-MHWRWJLKSA-N.

Identity
Molecular formulaC21H12ClFN2O5
Molecular weight426.8 g/mol
IUPAC name2-chloro-5-[5-[(E)-[1-(4-fluorophenyl)-3,5-dioxopyrazolidin-4-ylidene]methyl]furan-2-yl]benzoic acid
InChIKeyCQLKMZCZYWHROC-MHWRWJLKSA-N
SMILESC1=CC(=CC=C1N2C(=O)/C(=C/C3=CC=C(O3)C4=CC(=C(C=C4)Cl)C(=O)O)/C(=O)N2)F

Computed by PubChem (NCBI)