Structure

Urea,N-methyl-N'-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-

CAS
874290-99-0
Catalog Number
ACM874290990
Category
Other Products
Molecular Weight
294.15442
Molecular Formula
C14H21BN2O3

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Specification

Synonyms
MolPort-001-768-321, BM381, OR3450, 4-(3-Methylureido)phenylboronic acid pinacol ester, 874290-99-0
IUPAC Name
1-methyl-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)NC(=O)NC
InChI Key
MRHQTDZUJNAZGQ-UHFFFAOYSA-N
Boiling Point
378.3ºC at 760 mmHg
Melting Point
183-187ºC
Flash Point
182.6ºC
Density
1.1g/cm³
Exact Mass
276.16500
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
3
H-Bond Donor
2

Downstream Synthesis Route 1

  • 1062175-07-8
  • 874290-99-0
  • 1062161-85-6

Reference: [1]Zask, Arie; Verheijen, Jeroen C.; Curran, Kevin; Kaplan, Joshua; Richard, David J.; Nowak, Pawel; Malwitz, David J.; Brooijmans, Natasja; Bard, Joel; Svenson, Kristine; Lucas, Judy; Toral-Barza, Lourdes; Zhang, Wei-Guo; Hollander, Irwin; Gibbons, James J.; Abraham, Robert T.; Ayral-Kaloustian, Semiramis; Mansour, Tarek S.; Yu, Ker
[Journal of Medicinal Chemistry, 2009, vol. 52, # 16, p. 5013 - 5016]

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

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