4-chloranyl-5-methyl-2-propan-2-yl-phenol; dodecane-1-thiol

Systemtic Name: 4-chloranyl-5-methyl-2-propan-2-yl-phenol; dodecane-1-thiol Openeye Name: 4-chloro-2-isopropyl-5-methyl-phenol; dodecane-1-thiol CAS Name: 4-chloro-5-methyl-2-propan-2-ylphenol; 1-dodecanethiol IUPAC Name: 4-chloro-5-methyl-2-propan-2-ylphenol; dodecane-1-thiol Traditional Name: 4-chloro-2-isopropyl-5-methyl-phenol; dodecane-1-thiol Formula: C22H39ClOS MolecularWeight: 387.06246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCS.CC1=CC(=C(C=C1Cl)C(C)C)O

Isomeric SMILES

CCCCCCCCCCCCS.CC1=CC(=C(C=C1Cl)C(C)C)O

InChI

InChI=1S/C12H26S.C10H13ClO/c1-2-3-4-5-6-7-8-9-10-11-12-13;1-6(2)8-5-9(11)7(3)4-10(8)12/h13H,2-12H2,1H3;4-6,12H,1-3H3