2-tert-butylphenol; 2-dodecylphenol; 2-nonylphenol; 2-(2,4,4-trimethylpentan-2-yl)phenol

Systemtic Name: 2-tert-butylphenol; 2-dodecylphenol; 2-nonylphenol; 2-(2,4,4-trimethylpentan-2-yl)phenol Openeye Name: 2-tert-butylphenol; 2-dodecylphenol; 2-nonylphenol; 2-(1,1,3,3-tetramethylbutyl)phenol CAS Name: 2-tert-butylphenol; 2-dodecylphenol; 2-nonylphenol; 2-(2,4,4-trimethylpentan-2-yl)phenol IUPAC Name: 2-tert-butylphenol; 2-dodecylphenol; 2-nonylphenol; 2-(2,4,4-trimethylpentan-2-yl)phenol Traditional Name: 2-tert-butylphenol; 2-laurylphenol; 2-nonylphenol; 2-(1,1,3,3-tetramethylbutyl)phenol Formula: C57H90O4 MolecularWeight: 839.3221

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1O.CCCCCCCCCC1=CC=CC=C1O.CC(C)(C)CC(C)(C)C1=CC=CC=C1O.CC(C)(C)C1=CC=CC=C1O

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1O.CCCCCCCCCC1=CC=CC=C1O.CC(C)(C)CC(C)(C)C1=CC=CC=C1O.CC(C)(C)C1=CC=CC=C1O

InChI

InChI=1S/C18H30O.C15H24O.C14H22O.C10H14O/c1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16-18(17)19;1-2-3-4-5-6-7-8-11-14-12-9-10-13-15(14)16;1-13(2,3)10-14(4,5)11-8-6-7-9-12(11)15;1-10(2,3)8-6-4-5-7-9(8)11/h12-13,15-16,19H,2-11,14H2,1H3;9-10,12-13,16H,2-8,11H2,1H3;6-9,15H,10H2,1-5H3;4-7,11H,1-3H3