N-[5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl]acetamide
Completing data — refresh the page later to see the latest
Basic information
- CAS
1201645-46-6- Standard SMILES
CC(=O)Nc1cncc(B2OC(C)(C)C(C)(C)O2)c1- InChIKey
ADPVUZOCOXRLMP-UHFFFAOYSA-N- Molecular formula
- C13H19BN2O3
- Average molar mass
- 262.11 g/mol
- Monoisotopic mass
- 262.1488726
Names & identifiers
- Preferred name
- N-[5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl]acetamide
- IUPAC
- N-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinyl]acetamide
- English name
- N-(5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl)acetamide
- Molecular formula
- C13H19BN2O3
- Molecular weight
- 262.11
Names & synonyms
N-(5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl)acetamideN-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl]acetamideDTXSID00725468RefChem:828825DTXCID90676213103-313-11201645-46-6MFCD118782885-(ACETAMIDO)PYRIDINE-3-BORONIC ACID PINACOL ESTERAcetamide, N-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinyl]-N-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridyl]acetamideADPVUZOCOXRLMP-UHFFFAOYSA-N
Show more names
5-Acetamidopyridine-3-boronicacidpinacolester,98%N-(5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)5-N-Acetyl-amino-pyridin-3-ylboronic acid pinacol esterN-[5-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-3-pyridinyl]-acetamideN-(5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl)acetamide 95%min
5-Acetamidopyridine-3-boronic Acid Pinacol EsterSCHEMBL1559181(5-ACETAMIDOPYRIDIN-3-YL)BORONIC ACID PINACOL ESTERAKOS016007487MB11056DS-15350FN159963SY047288
Database identifiers
- CAS
1201645-46-6- PubChem CID
- 57415705
- DTXSID
DTXSID00725468- EC Number
- 103-313-1
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 60.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 344
Physicochemical properties
- Boiling point
- 441.8 · 441.8±30.0 °C(Predicted)
- Density
- 1.11 · 1.11±0.1 g/cm3 (20 ºC 760 Torr)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- form
- Solid
- pka
- 14.3 · 14.30±0.70(Predicted)
- Appearance
- White to off-white Solid
- CAS DataBase Reference
- 1201645 · 1201645-46-6
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
- Hazard Codes
- T
- Risk Statements
- 25 · 25
- Safety Statements
- 45 · 45
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- risk_code
- 25
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- T
- safety_code
- 45
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…