1328-0139 Screening compound: 4-[(4-chlorophenoxy)methyl]-2-phenyl-1,3,2-dioxaborolane

1328-0139 Screening compound: 4-[(4-chlorophenoxy)methyl]-2-phenyl-1,3,2-dioxaborolane
1328-0139 Screening compound: 4-[(4-chlorophenoxy)methyl]-2-phenyl-1,3,2-dioxaborolane alternative view

Chemical Structure Depiction of ChemDiv screening compound 1328-0139
4-[(4-chlorophenoxy)methyl]-2-phenyl-1,3,2-dioxaborolane

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

1328-0139

Molecular Formula

C15H14BClO3 (C15 H14 BClO3)

Compound Name

4-[(4-chlorophenoxy)methyl]-2-phenyl-1,3,2-dioxaborolane

IUPAC name

4-[(4-chlorophenoxy)methyl]-2-phenyl-132-dioxaborolane

SMILES

Clc(cc1)ccc1OCC1OB(c2ccccc2)OC1

InChI

InChI=1S/C15H14BClO3/c17-13-6-8-14(9-7-13)18-10-15-11-19-16(20-15)12-4-2-1-3-5-12/h1-9,15H,10-11H2/t15-/m0/s1

InChI Key

XSLLVTCJWSNEBR-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD00808045

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

288.54

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.195

Distribution Coefficient, logD

4.195

Water Solubility, LogSw

-4.44

Polar Surface Area

26.197

Acid Dissociation Constant (pKa)

26.20

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with 1328-0139 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1328-0139?
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What is the minimum amount of 1328-0139 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1328-0139
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1328-0139
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 1328-0139 available by request