Structure

(3-Methanesulfonylaminomethyl)benzeneboronic acid

CAS
850568-39-7
Catalog Number
ACM850568397
Category
Other Products
Molecular Weight
229.06
Molecular Formula
C8H12BNO4S

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Specification

Synonyms
850568-39-7, 3-[(Methylsulphonylamino)methyl]benzeneboronic acid, (3-(Methylsulfonamidomethyl)phenyl)boronic acid, (3-Methanesulfonylaminomethyl)phenylboronic acid, SureCN532278, CTK8B3983, MolPort-001-760-776, WT824, ANW-43599, OR1323, AKOS015893656, AB26386, AK-92352, KB-01548, 3-(methanesulfonamidomethyl)phenylboronic acid, (3-Methanesulfonylaminomethyl)phenylboronic acid,, [3-(methanesulfonamidomethyl)phenyl]boronic acid, [3-(methylsulfonylaminomethyl)phenyl]boronic acid, 3-METHANESULFONAMIDOMETHYLPHENYLBORONIC ACID, A841115
IUPAC Name
[3-(methanesulfonamidomethyl)phenyl]boronic acid
InChI Key
FJSWJJOLFPIDER-UHFFFAOYSA-N
Boiling Point
470.3ºC at 760 mmHg
Melting Point
246-248ºC
Flash Point
238.3ºC
Density
1.36g/cm³
Exact Mass
229.05800
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
5
H-Bond Donor
3

Downstream Synthesis Route 1

  • 850568-39-7
  • 1137278-60-4
  • 1137278-77-3

Reference: [1]Current Patent Assignee: ROCHE HOLDING AG - WO2009/42607, 2009, A1
Location in patent: Page/Page column 87

Downstream Synthesis Route 2

  • 850568-39-7
  • 1078734-14-1
  • 1193525-29-9

Reference: [1]Location in patent: experimental part
Bey, Emmanuel; Marchais-Oberwinkler, Sandrine; Negri, Matthias; Kruchten, Patricia; Oster, Alexander; Klein, Tobias; Spadaro, Alessandro; Werth, Ruth; Frotscher, Martin; Birk, Barbara; Hartmann, Rolf W.
[Journal of Medicinal Chemistry, 2009, vol. 52, # 21, p. 6724 - 6743]

Downstream Synthesis Route 3

  • 850568-39-7
  • 1246372-52-0
  • 1246372-87-1

Reference: [1]Current Patent Assignee: FUNDACION CENTRO NACIONAL DE INVESTIGACIONES ONCOLOGICAS CARLOS III ES - WO2010/112874, 2010, A1
Location in patent: Page/Page column 68

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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