0584-0273 Screening compound: 2-(4-nitrophenyl)-2-oxoethyl 3,5-dinitrobenzoate

0584-0273 Screening compound: 2-(4-nitrophenyl)-2-oxoethyl 3,5-dinitrobenzoate
0584-0273 Screening compound: 2-(4-nitrophenyl)-2-oxoethyl 3,5-dinitrobenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0584-0273
2-(4-nitrophenyl)-2-oxoethyl 3,5-dinitrobenzoate

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

0584-0273

Molecular Formula

C15H9N3O9 (C15 H9 N3 O9)

Compound Name

2-(4-nitrophenyl)-2-oxoethyl 3,5-dinitrobenzoate

IUPAC name

2-(4-nitrophenyl)-2-oxoethyl 35-dinitrobenzoate

SMILES

[O-][N+](c(cc1)ccc1C(COC(c1cc([N+]([O-])=O)cc([N+]([O-])=O)c1)=O)=O)=O

InChI

InChI=1S/C15H9N3O9/c19-14(9-1-3-11(4-2-9)16(21)22)8-27-15(20)10-5-12(17(23)24)7-13(6-10)18(25)26/h1-7H,8H2

InChI Key

BCPURITUIINBPJ-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

375.25

Hydrogen Bond Acceptors Count

17.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

2.819

Distribution Coefficient, logD

2.819

Water Solubility, LogSw

-3.37

Polar Surface Area

134.488

Acid Dissociation Constant (pKa)

22.85

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

References: we are preparing a list of scientific research reports with 0584-0273 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0584-0273?
Check Price and Availability of 0584-0273, 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 0584-0273 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0584-0273
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0584-0273
  • 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 0584-0273 available by request