Basic information
- CAS
71889-05-9- Standard SMILES
Cc1cc(C(OB(O)O)(c2cc(C)c(N)c(C)c2)c2c(Cl)cccc2Cl)cc(C)c1N- InChIKey
YAFGLTCOVKGWQR-UHFFFAOYSA-N- Molecular formula
- C23H25BCl2N2O3
- Average molar mass
- 459.2 g/mol
- Monoisotopic mass
- 458.1335282
Names & identifiers
- Preferred name
- Benzenemethanol, 4-amino-alpha-(4-amino-3,5-dimethylphenyl)-alpha-(2,6-dichlorophenyl)-3,5-dimethyl-, ester with boric acid (H3BO3) (1:1)
- IUPAC
- [bis(4-amino-3,5-dimethylphenyl)-(2,6-dichlorophenyl)methoxy]boronic acid
- English name
- 4,4'-diamino-3,3',5,5'-tetramethyl-2'',6''-trityl alcohol, monoester with boric acid
- Molecular formula
- C23H25BCl2N2O3
- Molecular weight
- 459.17
Names & synonyms
71889-05-9EINECS 276-164-4Benzenemethanol, 4-amino-alpha-(4-amino-3,5-dimethylphenyl)-alpha-(2,6-dichlorophenyl)-3,5-dimethyl-, monoester with boric acid (H3BO3)DTXSID8072453Benzenemethanol, 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)RefChem:117675DTXCID6047151Benzenemethanol, 4-amino-.alpha.-(4-amino-3,5-dimethylphenyl)-.alpha.-(2,6-dichlorophenyl)-3,5-dimethyl-, ester with boric acid (H3BO3) (1:1)4,4'-Diamino-3,3',5,5'-tetramethyl-2'',6''-trityl alcohol, monoester with boric acidNS00037300Bis(4-amino-3,5-dimethylphenyl)(2,6-dichlorophenyl)methyl dihydrogen borate
Show more names
Boric acid dihydrogen 4-amino-α-(4-amino-3,5-dimethylphenyl)-α-(2,6-dichlorophenyl)-3,5-dimethylbenzyl esterBenzenemethanol, 4-amino-α-(4-amino-3,5-dimethylphenyl)-α-(2,6-dichlorophenyl)-3,5-dimethyl-, ester with boric acid (H3BO3) (1:1)Benzenemethanol, 4-amino-α-(4-amino- 3,5-dimethylphenyl)-α-(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-, monoester with boric acid
Database identifiers
- CAS
71889-05-9- PubChem CID
- 3085653
- DTXSID
DTXSID8072453- EC Number
- 276-164-4
- Nikkaji
- J318.808F
Properties
Computed structural properties
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 537
Physicochemical properties
- EPA Substance Registry System
- 4 · Benzenemethanol, 4-amino-.alpha.-(4-amino-3,5-dimethylphenyl)-.alpha.-(2,6-dichlorophenyl)-3,5-dimethyl-, monoester with boric acid (H3BO3) (71889-05-9)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzenemethanol, 4-amino-.alpha.-(4-amino-3,5-dimethylphenyl)-.alpha.-(2,6-dichlorophenyl)-3,5-dimethyl-, ester with boric acid (H3BO3) (1:1): INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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