0868-0374 Screening compound: 3-(4-nitrophenoxy)phenyl 4-nitrobenzoate

0868-0374 Screening compound: 3-(4-nitrophenoxy)phenyl 4-nitrobenzoate
0868-0374 Screening compound: 3-(4-nitrophenoxy)phenyl 4-nitrobenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0868-0374
3-(4-nitrophenoxy)phenyl 4-nitrobenzoate

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

0868-0374

Molecular Formula

C19H12N2O7 (C19 H12 N2 O7)

Compound Name

3-(4-nitrophenoxy)phenyl 4-nitrobenzoate

IUPAC name

3-(4-nitrophenoxy)phenyl 4-nitrobenzoate

SMILES

[O-][N+](c(cc1)ccc1C(Oc1cccc(Oc(cc2)ccc2[N+]([O-])=O)c1)=O)=O

InChI

InChI=1S/C19H12N2O7/c22-19(13-4-6-14(7-5-13)20(23)24)28-18-3-1-2-17(12-18)27-16-10-8-15(9-11-16)21(25)26/h1-12H

InChI Key

JPSCBXIKDBIIRM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00349605

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.31

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

4.753

Distribution Coefficient, logD

4.753

Water Solubility, LogSw

-4.98

Polar Surface Area

94.127

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 0868-0374 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0868-0374?
Check Price and Availability of 0868-0374, 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 0868-0374 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0868-0374
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0868-0374
  • 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 0868-0374 available by request