2,6-Dimethyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine

HCID 21980034CAS 693774-10-6

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Basic information

Standard SMILES: Cc1ccc(B2OC(C)(C)C(C)(C)O2)c(C)n1
InChIKey: SKHNRJKSLVTZJH-UHFFFAOYSA-N
Molecular formula: C13H20BNO2
Average molar mass: 233.12 g/mol
Monoisotopic mass: 233.15870928

Names & identifiers

Preferred name: 2,6-Dimethyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
IUPAC: 2,6-dimethyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
English name: 3-Hydroxy-2,3-diMethylbutan-2-yl hydrogen (2,6-diMethylpyridin-3-yl)boronate
Molecular formula: C13H20BNO2
Molecular weight: 233.11

Names & synonyms

693774-10-62,6-Dimethyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine2,6-Dimethylpyridine-3-boronic Acid Pinacol EsterMFCD13195066SCHEMBL489927DTXSID306211062,6-Dimethylpyridine-3-boronicacidpinacolester3-Hydroxy-2,3-diMethylbutan-2-yl hydrogen (2,6-diMethylpyridin-3-yl)boronate2,6-dimTCB774102,6-dimethyl-3-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-pyridineAKOS016005853

Show more names

(2,6-Dimethylpyridin-3-yl)methanediol pinacol ester(2,6-Dimethy|pyridin -3- y|)methanedio| pinaco| ester2,6-Dimethyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)Pyridine, 2,6-dimethyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxabor...

Pyridine, 2,6-dimethyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-FD10079AC-33300DS-15601SY029386DB-111762CS-0036233EN300-822212

Database identifiers

CAS: 693774-10-6
PubChem CID: 21980034
DTXSID: DTXSID30621106
EC Number: 139-924-5

Properties

Computed structural properties

Topological polar surface area: 31.4 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 17
Formal charge: 0
Complexity: 277

Physicochemical properties

storage temp.: 2 · under inert gas (nitrogen or Argon) at 2-8°C
Appearance: Light brown to brown Liquid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338
HS Code: 2934999090 · 2934999090

Safety & regulation

GHS classification

GHS Classification · 4 items

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.