ethane-1,1-diol; 2-ethyl-4-iodanyl-phenol

Systemtic Name: ethane-1,1-diol; 2-ethyl-4-iodanyl-phenol Openeye Name: ethane-1,1-diol; 2-ethyl-4-iodo-phenol CAS Name: ethane-1,1-diol; 2-ethyl-4-iodophenol IUPAC Name: ethane-1,1-diol; 2-ethyl-4-iodophenol Traditional Name: ethane-1,1-diol; 2-ethyl-4-iodo-phenol Formula: C10H15IO3 MolecularWeight: 310.12877

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)I)O.CC(O)O

Isomeric SMILES

CCC1=C(C=CC(=C1)I)O.CC(O)O

InChI

InChI=1S/C8H9IO.C2H6O2/c1-2-6-5-7(9)3-4-8(6)10;1-2(3)4/h3-5,10H,2H2,1H3;2-4H,1H3