2,2-bis(2-ethylhexyl)hexanedioate; dioctyltin(2+)

Systemtic Name: 2,2-bis(2-ethylhexyl)hexanedioate; dioctyltin(2+) Openeye Name: 2,2-bis(2-ethylhexyl)hexanedioate; dioctyltin(2+) CAS Name: 2,2-bis(2-ethylhexyl)hexanedioate; dioctyltin(2+) IUPAC Name: 2,2-bis(2-ethylhexyl)hexanedioate; dioctyltin(2+) Traditional Name: 2,2-bis(2-ethylhexyl)adipate; dioctyltin(2+) Formula: C38H74O4Sn MolecularWeight: 713.70176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[Sn+2]CCCCCCCC.CCCCC(CC)CC(CCCC(=O)[O-])(CC(CC)CCCC)C(=O)[O-]

Isomeric SMILES

CCCCCCCC[Sn+2]CCCCCCCC.CCCCC(CC)CC(CCCC(=O)[O-])(CC(CC)CCCC)C(=O)[O-]

InChI

InChI=1S/C22H42O4.2C8H17.Sn/c1-5-9-12-18(7-3)16-22(21(25)26,15-11-14-20(23)24)17-19(8-4)13-10-6-2;2*1-3-5-7-8-6-4-2;/h18-19H,5-17H2,1-4H3,(H,23,24)(H,25,26);2*1,3-8H2,2H3;/q;;;+2/p-2