Products 50512-35-1

CAS 50512-35-1 appears in our catalog under these names: Isoprothiolane, 95%, Isoprothiolane, >95% (HPLC), Isoprothiolane, Isoprothiolane 10 µg/mL in Acetonitrile, Isoprothiolane, 99.91%. Offered by: Combi-blocks, TRC, Dr. Ehrenstorfer, TargetMol, GLPBio. Available pack sizes: 1g, 100mg, 2,5g, 250mg, 10ml, 10mg, 25mg, 50mg.

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

Isoprothiolane is a malonate ester that is diisopropyl malonate in which the two methylene hydrogens at position 2 are replaced by a 1,3-dithiolan-2-ylidene group. An insecticide and fungicide used to control a range of diseases including Pyricularia oryzae, Helminthosporium sigmoideum and Fusarium nivale. It has a role as an insecticide, an environmental contaminant, a phospholipid biosynthesis inhibitor and an antifungal agrochemical. It is an isopropyl ester, a malonate ester and a member of dithiolanes. It is functionally related to a malonic acid. It derives from a hydride of a 1,3-dithiolane.

Source: ChEBI

Identity
Molecular formulaC12H18O4S2
Molecular weight290.4 g/mol
IUPAC namedipropan-2-yl 2-(1,3-dithiolan-2-ylidene)propanedioate
InChIKeyUFHLMYOGRXOCSL-UHFFFAOYSA-N
SMILESCC(C)OC(=O)C(=C1SCCS1)C(=O)OC(C)C

Computed by PubChem (NCBI)