0108-0019 Screening compound: 1-nitro-4-[3-(4-nitrophenoxy)phenoxy]benzene

0108-0019 Screening compound: 1-nitro-4-[3-(4-nitrophenoxy)phenoxy]benzene
0108-0019 Screening compound: 1-nitro-4-[3-(4-nitrophenoxy)phenoxy]benzene alternative view

Chemical Structure Depiction of ChemDiv screening compound 0108-0019
1-nitro-4-[3-(4-nitrophenoxy)phenoxy]benzene

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

0108-0019

Molecular Formula

C18H12N2O6 (C18 H12 N2 O6)

Compound Name

1-nitro-4-[3-(4-nitrophenoxy)phenoxy]benzene

IUPAC name

1-nitro-4-[3-(4-nitrophenoxy)phenoxy]benzene

SMILES

[O-][N+](c(cc1)ccc1Oc1cccc(Oc(cc2)ccc2[N+]([O-])=O)c1)=O

InChI

InChI=1S/C18H12N2O6/c21-19(22)13-4-8-15(9-5-13)25-17-2-1-3-18(12-17)26-16-10-6-14(7-11-16)20(23)24/h1-12H

InChI Key

GGQPNVUCTKRSFS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00024651

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

352.3

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.372

Distribution Coefficient, logD

5.372

Water Solubility, LogSw

-5.91

Polar Surface Area

80.497

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0108-0019 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 0108-0019 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0108-0019?
Check Price and Availability of 0108-0019, 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 0108-0019 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0108-0019
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0108-0019
  • 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 0108-0019 available by request