2-bromanylpentane; 1-butoxybutane; 1,3-di(propan-2-yl)benzene

Systemtic Name: 2-bromanylpentane; 1-butoxybutane; 1,3-di(propan-2-yl)benzene Openeye Name: 2-bromopentane; 1-butoxybutane; 1,3-diisopropylbenzene CAS Name: 2-bromopentane; 1-butoxybutane; 1,3-di(propan-2-yl)benzene IUPAC Name: 2-bromopentane; 1-butoxybutane; 1,3-di(propan-2-yl)benzene Traditional Name: 2-bromopentane; 1-butoxybutane; 1,3-diisopropylbenzene Formula: C25H47BrO MolecularWeight: 443.54408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCCC.CCCC(C)Br.CC(C)C1=CC(=CC=C1)C(C)C

Isomeric SMILES

CCCCOCCCC.CCCC(C)Br.CC(C)C1=CC(=CC=C1)C(C)C

InChI

InChI=1S/C12H18.C8H18O.C5H11Br/c1-9(2)11-6-5-7-12(8-11)10(3)4;1-3-5-7-9-8-6-4-2;1-3-4-5(2)6/h5-10H,1-4H3;3-8H2,1-2H3;5H,3-4H2,1-2H3