ethyl ethanoate; 1-iodanyl-4-methyl-pentane

Systemtic Name: ethyl ethanoate; 1-iodanyl-4-methyl-pentane Openeye Name: ethyl acetate; 1-iodo-4-methyl-pentane CAS Name: acetic acid ethyl ester; 1-iodo-4-methylpentane IUPAC Name: ethyl acetate; 1-iodo-4-methylpentane Traditional Name: acetic acid ethyl ester; 1-iodo-4-methyl-pentane Formula: C10H21IO2 MolecularWeight: 300.17701

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C.CC(C)CCCI

Isomeric SMILES

CCOC(=O)C.CC(C)CCCI

InChI

InChI=1S/C6H13I.C4H8O2/c1-6(2)4-3-5-7;1-3-6-4(2)5/h6H,3-5H2,1-2H3;3H2,1-2H3