8011-0903 Screening compound: butyl (2E)-3-[5-(4-chlorophenyl)-2-furyl]-2-cyanoacrylate

8011-0903 Screening compound: butyl (2E)-3-[5-(4-chlorophenyl)-2-furyl]-2-cyanoacrylate
8011-0903 Screening compound: butyl (2E)-3-[5-(4-chlorophenyl)-2-furyl]-2-cyanoacrylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8011-0903
butyl (2E)-3-[5-(4-chlorophenyl)-2-furyl]-2-cyanoacrylate

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

8011-0903

Molecular Formula

C18H16ClNO3 (C18 H16 ClNO3)

Compound Name

butyl (2E)-3-[5-(4-chlorophenyl)-2-furyl]-2-cyanoacrylate

IUPAC name

n/a

SMILES

CCCCOC(/C(/C#N)=C/c1ccc(-c(cc2)ccc2Cl)o1)=O

InChI

InChI=1S/C18H16ClNO3/c1-2-3-10-22-18(21)14(12-20)11-16-8-9-17(23-16)13-4-6-15(19)7-5-13/h4-9,11H,2-3,10H2,1H3

InChI Key

YIUDRBUTLSAACK-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

329.78

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

5.528

Distribution Coefficient, logD

5.528

Water Solubility, LogSw

-5.98

Polar Surface Area

45.912

Acid Dissociation Constant (pKa)

28.32

Base Dissociation Constant (pKb)

-5.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.22

References: we are preparing a list of scientific research reports with 8011-0903 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8011-0903?
Check Price and Availability of 8011-0903, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 8011-0903 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8011-0903
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8011-0903
  • 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 8011-0903 available by request