3-tert-butylbenzene-1,2-diol; 4-tert-butylphenol; methanal

Systemtic Name: 3-tert-butylbenzene-1,2-diol; 4-tert-butylphenol; methanal Openeye Name: 3-tert-butylbenzene-1,2-diol; 4-tert-butylphenol; formaldehyde CAS Name: 3-tert-butylbenzene-1,2-diol; 4-tert-butylphenol; formaldehyde IUPAC Name: 3-tert-butylbenzene-1,2-diol; 4-tert-butylphenol; formaldehyde Traditional Name: 4-tert-butylphenol; 3-tert-butylpyrocatechol; formaldehyde Formula: C21H30O4 MolecularWeight: 346.4605

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14O2.C10H14O.CH2O/c1-10(2,3)7-5-4-6-8(11)9(7)12;1-10(2,3)8-4-6-9(11)7-5-8;1-2/h4-6,11-12H,1-3H3;4-7,11H,1-3H3;1H2