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CHEMBRDG-BB 4012533

CHEMBRDG-BB 4012533 structure

CHEMBRDG-BB 4012533 

structure
  • CAS No:

    265664-52-6

  • Formula:

    C9H13BO4

  • Chemical Name:

    CHEMBRDG-BB 4012533

  • Synonyms:

    [4-(2-methoxyethoxy)phenyl]boronic acid(SALTDATA: FREE);4-(2-Methoxyethoxy)benzeneboronic acid, 95%;[4-(2-methoxyethoxy)phenyl]boranediol;B-[4-(2-methoxyethoxy)phenyl]Boronic acid;CHEMBRDG-BB 4012533;[4-(2-METHOXYETHOXY)PHENYL]BORONIC ACID;UKRORGSYN-BB BBV-2090368

CHEMBRDG-BB 4012533 Basic Attributes

196.01

196.09100

DTXSID20634609

2931900090

Characteristics

58.9

1.162g/cm3

172.213ºC

1.512

Safety Information

41

26-39

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 3 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

CHEMBRDG-BB 4012533 Use and Manufacturing

STEP 3: A stirred solution of E33 (3.47 g, 12.50 mmol) and acetone (75 mL) was treated with a solution of ammonium acetate (4 equiv., 3.85 g, 49.9 mmol) in water (75 mL). Sodium periodate (4 equiv., 10.7 g, 49.9 mmol) was then added portionwise. The yellow/white suspension was vigourously stirred at room temperature for 36 hours. The mixture was then filtered, and the insoluble material was washed with ethyl acetate. The combined filtrates were evaporated under reduced pressure and the residue was extracted several times with ethyl acetate. The combined extracts were dried (MgSC^) and evaporated under reduced pressure to afford the crude product as a white solid. This was purified by chromatography (CombiFlash Rf. iso-hexane/EtOAc, 0percent to 70percent) to afford E34 as a white solid (875 mg). 1Hnmr(CDCl

Computed Properties

Molecular Weight:196.01
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:196.0906891
Monoisotopic Mass:196.0906891
Topological Polar Surface Area:58.9
Heavy Atom Count:14
Complexity:146
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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