chloromethylbenzene; dihydrogen borate

Systemtic Name: chloromethylbenzene; dihydrogen borate Openeye Name: chloromethylbenzene; dihydrogen borate CAS Name: chloromethylbenzene; dihydrogen borate IUPAC Name: chloromethylbenzene; dihydrogen borate Traditional Name: chloromethylbenzene; dihydrogen borate Formula: C28H30BCl4O3- MolecularWeight: 567.159

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Descriptors Computed from Structure

Canonical SMILES:

B(O)(O)[O-].C1=CC=C(C=C1)CCl.C1=CC=C(C=C1)CCl.C1=CC=C(C=C1)CCl.C1=CC=C(C=C1)CCl

Isomeric SMILES

B(O)(O)[O-].C1=CC=C(C=C1)CCl.C1=CC=C(C=C1)CCl.C1=CC=C(C=C1)CCl.C1=CC=C(C=C1)CCl

InChI

InChI=1S/4C7H7Cl.BH2O3/c4*8-6-7-4-2-1-3-5-7;2-1(3)4/h4*1-5H,6H2;2-3H/q;;;;-1