1-bromanyl-4-(4-pentylcyclohexyl)benzene; [4-(4-pentylcyclohexyl)phenyl]boronic acid

Systemtic Name: 1-bromanyl-4-(4-pentylcyclohexyl)benzene; [4-(4-pentylcyclohexyl)phenyl]boronic acid Openeye Name: 1-bromo-4-(4-pentylcyclohexyl)benzene; [4-(4-pentylcyclohexyl)phenyl]boronic acid CAS Name: 1-bromo-4-(4-pentylcyclohexyl)benzene; [4-(4-pentylcyclohexyl)phenyl]boronic acid IUPAC Name: 1-bromo-4-(4-pentylcyclohexyl)benzene; [4-(4-pentylcyclohexyl)phenyl]boronic acid Traditional Name: 1-(4-amylcyclohexyl)-4-bromo-benzene; [4-(4-amylcyclohexyl)phenyl]boronic acid Formula: C34H52BBrO2 MolecularWeight: 583.49048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=C(C=C1)C2CCC(CC2)CCCCC)(O)O.CCCCCC1CCC(CC1)C2=CC=C(C=C2)Br

Isomeric SMILES

B(C1=CC=C(C=C1)C2CCC(CC2)CCCCC)(O)O.CCCCCC1CCC(CC1)C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H27BO2.C17H25Br/c1-2-3-4-5-14-6-8-15(9-7-14)16-10-12-17(13-11-16)18(19)20;1-2-3-4-5-14-6-8-15(9-7-14)16-10-12-17(18)13-11-16/h10-15,19-20H,2-9H2,1H3;10-15H,2-9H2,1H3