0666-0818 Screening compound: 2-(2,4-dichlorophenoxy)-5-nitrobenzene-1,4-dicarboxylic acid

0666-0818 Screening compound: 2-(2,4-dichlorophenoxy)-5-nitrobenzene-1,4-dicarboxylic acid
0666-0818 Screening compound: 2-(2,4-dichlorophenoxy)-5-nitrobenzene-1,4-dicarboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 0666-0818
2-(2,4-dichlorophenoxy)-5-nitrobenzene-1,4-dicarboxylic acid

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

0666-0818

Molecular Formula

C14H7Cl2NO7 (C14 H7 Cl2 NO7)

Compound Name

2-(2,4-dichlorophenoxy)-5-nitrobenzene-1,4-dicarboxylic acid

IUPAC name

2-(24-dichlorophenoxy)-5-nitrobenzene-14-dicarboxylic acid

SMILES

[O-][N+](c(c(C(O)=O)c1)cc(C(O)=O)c1Oc(ccc(Cl)c1)c1Cl)=O

InChI

InChI=1S/C14H7Cl2NO7/c15-6-1-2-11(9(16)3-6)24-12-5-7(13(18)19)10(17(22)23)4-8(12)14(20)21/h1-5H,(H,18,19)(H,20,21)

InChI Key

FPGLOEFBBNEWMN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00552992

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

372.12

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

4.128

Distribution Coefficient, logD

-1.437

Water Solubility, LogSw

-4.32

Polar Surface Area

97.056

Acid Dissociation Constant (pKa)

1.84

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0666-0818 in Drug Discovery

Included in Screening Libraries

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with 0666-0818 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0666-0818?
Check Price and Availability of 0666-0818, 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 0666-0818 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0666-0818
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0666-0818
  • 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 0666-0818 available by request