4-tert-butylphenol; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; methanal; phenol

Systemtic Name: 4-tert-butylphenol; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; methanal; phenol Openeye Name: 4-tert-butylphenol; formaldehyde; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol; phenol CAS Name: 4-tert-butylphenol; formaldehyde; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; phenol IUPAC Name: 4-tert-butylphenol; formaldehyde; 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol; phenol Traditional Name: 4-tert-butylphenol; formaldehyde; 4-[1-(4-hydroxyphenyl)-1-methyl-ethyl]phenol; phenol Formula: C32H38O5 MolecularWeight: 502.64112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C=O.C1=CC=C(C=C1)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)O.CC(C)(C1=CC=C(C=C1)O)C2=CC=C(C=C2)O.C=O.C1=CC=C(C=C1)O

InChI

InChI=1S/C15H16O2.C10H14O.C6H6O.CH2O/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12;1-10(2,3)8-4-6-9(11)7-5-8;7-6-4-2-1-3-5-6;1-2/h3-10,16-17H,1-2H3;4-7,11H,1-3H3;1-5,7H;1H2