0233-0103 Screening compound: 1,3,5-trinitro-2-(4-nitrophenoxy)benzene

0233-0103 Screening compound: 1,3,5-trinitro-2-(4-nitrophenoxy)benzene
0233-0103 Screening compound: 1,3,5-trinitro-2-(4-nitrophenoxy)benzene alternative view

Chemical Structure Depiction of ChemDiv screening compound 0233-0103
1,3,5-trinitro-2-(4-nitrophenoxy)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

0233-0103

Molecular Formula

C12H6N4O9 (C12 H6 N4 O9)

Compound Name

1,3,5-trinitro-2-(4-nitrophenoxy)benzene

IUPAC name

135-trinitro-2-(4-nitrophenoxy)benzene

SMILES

[O-][N+](c(cc1)ccc1Oc(c([N+]([O-])=O)cc([N+]([O-])=O)c1)c1[N+]([O-])=O)=O

InChI

InChI=1S/C12H6N4O9/c17-13(18)7-1-3-9(4-2-7)25-12-10(15(21)22)5-8(14(19)20)6-11(12)16(23)24/h1-6H

InChI Key

FVMZZFXJYIQEKS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00688175

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.2

Hydrogen Bond Acceptors Count

17.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

13

Partition Coefficient, logP

2.946

Distribution Coefficient, logD

2.946

Water Solubility, LogSw

-3.55

Polar Surface Area

140.084

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 0233-0103 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0233-0103?
Check Price and Availability of 0233-0103, 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 0233-0103 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0233-0103
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0233-0103
  • 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 0233-0103 available by request