8009-9870 Screening compound: 2-ethoxy-4-[2-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)phenoxy]-1-nitrobenzene

8009-9870 Screening compound: 2-ethoxy-4-[2-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)phenoxy]-1-nitrobenzene
8009-9870 Screening compound: 2-ethoxy-4-[2-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)phenoxy]-1-nitrobenzene alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-9870
2-ethoxy-4-[2-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)phenoxy]-1-nitrobenzene

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

8009-9870

Molecular Formula

C23H19F3N2O8 (C23 H19 F3 N2 O8)

Compound Name

2-ethoxy-4-[2-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)phenoxy]-1-nitrobenzene

IUPAC name

2-ethoxy-4-[2-(3-ethoxy-4-nitrophenoxy)-4-(trifluoromethyl)phenoxy]-1-nitrobenzene

SMILES

CCOc(cc(cc1)Oc(ccc(C(F)(F)F)c2)c2Oc(cc2)cc(OCC)c2[N+]([O-])=O)c1[N+]([O-])=O

InChI

InChI=1S/C23H19F3N2O8/c1-3-33-20-12-15(6-8-17(20)27(29)30)35-19-10-5-14(23(24,25)26)11-22(19)36-16-7-9-18(28(31)32)21(13-16)34-4-2/h5-13H,3-4H2,1-2H3

InChI Key

PZRDQYPAJNVMSW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02110242

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

508.41

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

6.183

Distribution Coefficient, logD

6.183

Water Solubility, LogSw

-5.73

Polar Surface Area

94.489

Acid Dissociation Constant (pKa)

29.85

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

References: we are preparing a list of scientific research reports with 8009-9870 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-9870?
Check Price and Availability of 8009-9870, 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 8009-9870 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-9870
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-9870
  • 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 8009-9870 available by request