butane; 1-tert-butyl-4-methyl-benzene; 1,3-ditert-butyl-5-methyl-benzene; tridecane; phosphite

Systemtic Name: butane; 1-tert-butyl-4-methyl-benzene; 1,3-ditert-butyl-5-methyl-benzene; tridecane; phosphite Openeye Name: butane; 1-tert-butyl-4-methyl-benzene; 1,3-ditert-butyl-5-methyl-benzene; tridecane; phosphite CAS Name: butane; 1-tert-butyl-4-methylbenzene; 1,3-ditert-butyl-5-methylbenzene; tridecane; phosphite IUPAC Name: butane; 1-tert-butyl-4-methylbenzene; 1,3-ditert-butyl-5-methylbenzene; tridecane; phosphite Traditional Name: 1-tert-butyl-4-methyl-benzene; 1,3-ditert-butyl-5-methyl-benzene; n-butane; tridecane; phosphite Formula: C43H78O3P-3 MolecularWeight: 674.051381

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Descriptors Computed from Structure

Canonical SMILES:

CCCC.CCCCCCCCCCCCC.CC1=CC=C(C=C1)C(C)(C)C.CC1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C.[O-]P([O-])[O-]

Isomeric SMILES

CCCC.CCCCCCCCCCCCC.CC1=CC=C(C=C1)C(C)(C)C.CC1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C.[O-]P([O-])[O-]

InChI

InChI=1S/C15H24.C13H28.C11H16.C4H10.O3P/c1-11-8-12(14(2,3)4)10-13(9-11)15(5,6)7;1-3-5-7-9-11-13-12-10-8-6-4-2;1-9-5-7-10(8-6-9)11(2,3)4;1-3-4-2;1-4(2)3/h8-10H,1-7H3;3-13H2,1-2H3;5-8H,1-4H3;3-4H2,1-2H3;/q;;;;-3