3109-1783 Screening compound: 2-(4-nitro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)ethyl acetate

3109-1783 Screening compound: 2-(4-nitro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)ethyl acetate
3109-1783 Screening compound: 2-(4-nitro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)ethyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 3109-1783
2-(4-nitro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)ethyl acetate

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

3109-1783

Molecular Formula

C12H10N2O6 (C12 H10 N2 O6)

Compound Name

2-(4-nitro-1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)ethyl acetate

IUPAC name

2-(4-nitro-13-dioxo-23-dihydro-1H-isoindol-2-yl)ethyl acetate

SMILES

CC(OCCN(C(c1cccc([N+]([O-])=O)c11)=O)C1=O)=O

InChI

InChI=1S/C12H10N2O6/c1-7(15)20-6-5-13-11(16)8-3-2-4-9(14(18)19)10(8)12(13)17/h2-4H,5-6H2,1H3

InChI Key

STPDJXUTAWXNRP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01797553

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

278.22

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.149

Distribution Coefficient, logD

0.149

Water Solubility, LogSw

-2.24

Polar Surface Area

83.971

Acid Dissociation Constant (pKa)

24.24

Base Dissociation Constant (pKb)

-10.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with 3109-1783 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3109-1783?
Check Price and Availability of 3109-1783, 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 3109-1783 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3109-1783
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3109-1783
  • 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 3109-1783 available by request