1-(3-Chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-YL)pyridin-2-YL)-4-methylpiperazine
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Basic information
- CAS
2096334-60-8- Standard SMILES
CN1CCN(c2ncc(B3OC(C)(C)C(C)(C)O3)cc2Cl)CC1- InChIKey
WBQPFRZNRGTRBN-UHFFFAOYSA-N- Molecular formula
- C16H25BClN3O2
- Average molar mass
- 337.7 g/mol
- Monoisotopic mass
- 337.1728349
Names & identifiers
- Preferred name
- 1-(3-Chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-YL)pyridin-2-YL)-4-methylpiperazine
- IUPAC
- 1-[3-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]-4-methylpiperazine
- English name
- 1-(3-Chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)-4-methylpiperazine
- Molecular formula
- C16H25BClN3O2
- Molecular weight
- 337.65
Names & synonyms
2096334-60-83-Chloro-2-(4-methylpiperazino)pyridine-5-boronic acid, pinacol ester1-(3-CHLORO-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIDIN-2-YL)-4-METHYLPIPERAZINEMFCD169965021-[3-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]-4-methylpiperazineC16H25BClN3O2AT14380MB20911BS-34403CS-01767473-Chloro-2-(4-methylpiperazino)pyridine-5-boronic acid pinacol ester1-[3-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridyl]-4-methyl-piperazine
Show more names
Piperazine, 1-[3-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]-4-methyl-
Database identifiers
- CAS
2096334-60-8
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 37.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 414
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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