8004-3426 Screening compound: (2,4-dinitrophenyl)methyl 2,4-dinitrobenzoate

8004-3426 Screening compound: (2,4-dinitrophenyl)methyl 2,4-dinitrobenzoate
8004-3426 Screening compound: (2,4-dinitrophenyl)methyl 2,4-dinitrobenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8004-3426
(2,4-dinitrophenyl)methyl 2,4-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

8004-3426

Molecular Formula

C14H8N4O10 (C14 H8 N4 O10)

Compound Name

(2,4-dinitrophenyl)methyl 2,4-dinitrobenzoate

IUPAC name

(24-dinitrophenyl)methyl 24-dinitrobenzoate

SMILES

[O-][N+](c1cc([N+]([O-])=O)c(COC(c(ccc([N+]([O-])=O)c2)c2[N+]([O-])=O)=O)cc1)=O

InChI

InChI=1S/C14H8N4O10/c19-14(11-4-3-10(16(22)23)6-13(11)18(26)27)28-7-8-1-2-9(15(20)21)5-12(8)17(24)25/h1-6H,7H2

InChI Key

VBUXGZSQQALNDX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00636947

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

392.24

Hydrogen Bond Acceptors Count

19.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

14

Partition Coefficient, logP

3.350

Distribution Coefficient, logD

3.350

Water Solubility, LogSw

-3.77

Polar Surface Area

154.020

Acid Dissociation Constant (pKa)

29.23

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

References: we are preparing a list of scientific research reports with 8004-3426 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8004-3426?
Check Price and Availability of 8004-3426, 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 8004-3426 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8004-3426
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8004-3426
  • 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 8004-3426 available by request