2,2-bis(2-ethylhexyl)hexanedioate; ditert-butyltin(2+)

Systemtic Name: 2,2-bis(2-ethylhexyl)hexanedioate; ditert-butyltin(2+) Openeye Name: 2,2-bis(2-ethylhexyl)hexanedioate; ditert-butyltin(2+) CAS Name: 2,2-bis(2-ethylhexyl)hexanedioate; ditert-butyltin(2+) IUPAC Name: 2,2-bis(2-ethylhexyl)hexanedioate; ditert-butyltin(2+) Traditional Name: 2,2-bis(2-ethylhexyl)adipate; ditert-butyltin(2+) Formula: C30H58O4Sn MolecularWeight: 601.48912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H42O4.2C4H9.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*1-4(2)3;/h18-19H,5-17H2,1-4H3,(H,23,24)(H,25,26);2*1-3H3;/q;;;+2/p-2