AC1MJ4UP structure

AC1MJ4UP

[bis(4-amino-3,5-dimethylphenyl)-(2,6-dichlorophenyl)methoxy]boronic acid

Also Known As: EINECS 276-164-4|Benzenemethanol, 4-amino-alpha-(4-amino-3,5-dimethylphenyl)-alpha-(2,6-dichlorophenyl)-3,5-dimethyl-, monoester with boric acid (H3BO3)|4,4'-Diamino-3,3',5,5'-tetramethyl-2'',6''-trityl alcohol, monoester with boric acid|Benzenemethanol, 4-amino-.alpha.-(4-amino-3,5-dimethylphenyl)-.alpha.-(2,6-dichlorophenyl)-3,5-dimethyl-, monoester with boric acid (H3BO3)|Benzenemethanol, 4-amino-alpha-(4-amino-3,5-dimethylphenyl)-alpha-(2,6-dichlorophenyl)-3,5-dimethyl-, ester with boric acid (H3BO3) (1:1)|[bis(4-amino-3,5-dimethylphenyl)-(2,6-dichlorophenyl)methoxy]boronic acid|[bis(4-amino-3,5-dimethylphenyl)(2,6-dichlorophenyl)methoxy]boronic acid|Bis(4-amino-3,5-dimethylphenyl)(2,6-dichlorophenyl)methyl dihydrogen borate|Benzenemethanol, 4-amino-.alpha.-(4-amino-3,5-dimethylphenyl)-.alpha.-(2,6-dichlorophenyl)-3,5-dimethyl-, ester with boric acid (H3BO3) (1:1)|Benzenemethanol, 4-amino-?-(4-amino- 3,5-dimethylphenyl)-?-(2,6-dichlorophenyl)-3 ,5-dimethyl-, monoester with boric acid (H3BO3)|Boric acid dihydrogen 4-amino-alpha-(4-amino-3,5-dimethylphenyl)-alpha-(2,6-dichlorophenyl)-3,5-dimethylbenzyl ester

CAS: 71889-05-9
Molecular Formula C23H25BCl2N2O3
Molecular Weight 458.1335 g/mol
LogP 4.66948
Topological Polar Surface Area 101.73 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 5
Rotatable Bonds 5
Exact Mass 458.1335
Monoisotopic Mass 458.1335
Heavy Atoms 31
Complexity 1027.9009

Chemical Identifiers

CAS Number 71889-05-9
SMILES B(O)(O)OC(C1=CC(=C(C(=C1)C)N)C)(C2=CC(=C(C(=C2)C)N)C)C3=C(C=CC=C3Cl)Cl

Product Overview

AC1MJ4UP (CAS 71889-05-9), with molecular formula C23H25BCl2N2O3 and molecular weight 458.1335 g/mol. IUPAC: [bis(4-amino-3,5-dimethylphenyl)-(2,6-dichlorophenyl)methoxy]boronic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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