Basic information
- CAS
232277-17-7- Standard SMILES
COc1cccc(N(C)C)c1B(O)O- InChIKey
STTOLIHGCZMUGV-UHFFFAOYSA-N- Molecular formula
- C9H14BNO3
- Average molar mass
- 195.03 g/mol
- Monoisotopic mass
- 195.10667371
Names & identifiers
- Preferred name
- 2-Dimethylamino-6-methoxyphenylboronic acid
- IUPAC
- [2-(dimethylamino)-6-methoxyphenyl]boronic acid
- English name
- 2-Dimethylamino-6-methoxyphenylboronic acid
- Molecular formula
- C9H14BNO3
- Molecular weight
- 195.02
Names & synonyms
232277-17-7[2-(dimethylamino)-6-methoxyphenyl]boronic acid2-DIMETHYLAMINO-6-METHOXYPHENYLBORONIC ACID(2-(Dimethylamino)-6-methoxyphenyl)boronic acid2-methoxy-6-dimethylamino-phenylboronic acidstarbld0019315SCHEMBL6502617Boronic acid,[2-(dimethylamino)-6-methoxyphenyl]- (9CI)DTXSID00402560STTOLIHGCZMUGV-UHFFFAOYSA-NMHA65556AKOS006276082
Show more names
2-Methoxy-6-(N,N-dimethylamino)benzene boronic acidBoronic acid, [2-(dimethylamino)-6-methoxyphenyl]- (9CI)
Database identifiers
- CAS
232277-17-7- PubChem CID
- 4374258
- DTXSID
DTXSID00402560
Properties
Computed structural properties
- Topological polar surface area
- 52.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 177
Physicochemical properties
- Boiling point
- 354.1 · 354.1±52.0 °C(Predicted)
- Density
- 1.15 · 1.15±0.1 g/cm3(Predicted)
- pka
- 8.89 · 8.89±0.58(Predicted)
Chemistry & industry
Suppliers1 total
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
3 records
Compound notes
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