(2,2-dimethyl-1,3-dioxolan-4-yl)methyl 8-bromanyloctanoate

Systemtic Name: (2,2-dimethyl-1,3-dioxolan-4-yl)methyl 8-bromanyloctanoate Openeye Name: (2,2-dimethyl-1,3-dioxolan-4-yl)methyl 8-bromooctanoate CAS Name: 8-bromooctanoic acid (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester IUPAC Name: (2,2-dimethyl-1,3-dioxolan-4-yl)methyl 8-bromooctanoate Traditional Name: 8-bromocaprylic acid (2,2-dimethyl-1,3-dioxolan-4-yl)methyl ester Formula: C14H25BrO4 MolecularWeight: 337.2499

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)COC(=O)CCCCCCCBr)C

Isomeric SMILES

CC1(OCC(O1)COC(=O)CCCCCCCBr)C

InChI

InChI=1S/C14H25BrO4/c1-14(2)18-11-12(19-14)10-17-13(16)8-6-4-3-5-7-9-15/h12H,3-11H2,1-2H3