Basic information
- CAS
89291-23-6- Standard SMILES
CN(C)c1ccccc1B(O)O- InChIKey
NLTUDNKQUJVGKP-UHFFFAOYSA-N- Molecular formula
- C8H12BNO2
- Average molar mass
- 165 g/mol
- Monoisotopic mass
- 165.09610902
Names & identifiers
- Preferred name
- (2-(Dimethylamino)phenyl)boronic acid
- IUPAC
- [2-(dimethylamino)phenyl]boronic acid
- English name
- 2-(Dimethylamine)phenylboronic acid
- Molecular formula
- C8H12BNO2
- Molecular weight
- 165
Names & synonyms
89291-23-6[2-(dimethylamino)phenyl]boronic acid(2-(Dimethylamino)phenyl)boronic acidDTXSID60402561RefChem:1049645DTXCID903534162-(DIMETHYLAMINO)PHENYLBORONIC ACID2-(Dimethylamine)phenylboronic acidMFCD013189972-Dimethylaminophenylboronic acid2-(Dimethylamino)phenylboronicAcid2-(Dimethylamine)phenylboronic acid;2-Dimethylaminophenylboronic acid
Show more names
AKOS BRN-0203CHEMBRDG-BB 40086722-(dimethylamino)benzeneboronic acid2-(N,N-DIMETHYLAMINO)PHENYLBORONIC ACIDBoronic acid, B-[2-(dimethylamino)phenyl]-(2-(Dimethylamino)phenyl)boronic acid - [D88666][2-(dimethylamino)phenyl]boronic acid(SALTDATA: HCl 0.7H2O)
Boronic acid, [2-(dimethylamino)phenyl]-SCHEMBL27870SCHEMBL29589969NLTUDNKQUJVGKP-UHFFFAOYSA-NN,N-dimethylaminobenzeneboronic acid(2-(Dimethylamino)phenyl)boronicacidAC1046AKOS003585311
Database identifiers
- CAS
89291-23-6- PubChem CID
- 4374259
- DTXSID
DTXSID60402561- Nikkaji
- J3.406.237D
Properties
Computed structural properties
- Topological polar surface area
- 43.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 141
Physicochemical properties
- Melting point
- 70 °C · 70 °C
- Boiling point
- 317 · 317.0±44.0 °C(Predicted)
- Density
- 1.12 · 1.12±0.1 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- pka
- 8.86 · 8.86±0.58(Predicted)
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
- HS Code
- 2931900090 · 2931900090
Safety & regulation
Safety data
- hs_code
- 2931900090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Applications
Uses2-(Dimethylamino)phenylboronic acid
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers47 total
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
Aladdin Scientific[email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
长沙麓兴生物科技有限公司0731-88827538 15574813303 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
Related reactions
2 records
Compound notes
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