3-(3-bromophenyl)-2,3-dimethyl-pentane-1,5-diol

Systemtic Name: 3-(3-bromophenyl)-2,3-dimethyl-pentane-1,5-diol Openeye Name: 3-(3-bromophenyl)-2,3-dimethyl-pentane-1,5-diol CAS Name: 3-(3-bromophenyl)-2,3-dimethylpentane-1,5-diol IUPAC Name: 3-(3-bromophenyl)-2,3-dimethylpentane-1,5-diol Traditional Name: 3-(3-bromophenyl)-2,3-dimethyl-pentane-1,5-diol Formula: C13H19BrO2 MolecularWeight: 287.19276

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)C(C)(CCO)C1=CC(=CC=C1)Br

Isomeric SMILES

CC(CO)C(C)(CCO)C1=CC(=CC=C1)Br

InChI

InChI=1S/C13H19BrO2/c1-10(9-16)13(2,6-7-15)11-4-3-5-12(14)8-11/h3-5,8,10,15-16H,6-7,9H2,1-2H3