8017-9262 Screening compound: 2-ethoxy-2-oxoethyl 2-amino-4,6-dinitrobenzoate

8017-9262 Screening compound: 2-ethoxy-2-oxoethyl 2-amino-4,6-dinitrobenzoate
8017-9262 Screening compound: 2-ethoxy-2-oxoethyl 2-amino-4,6-dinitrobenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8017-9262
2-ethoxy-2-oxoethyl 2-amino-4,6-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

8017-9262

Molecular Formula

C11H11N3O8 (C11 H11 N3 O8)

Compound Name

2-ethoxy-2-oxoethyl 2-amino-4,6-dinitrobenzoate

IUPAC name

ethyl 2-(2-amino-46-dinitrobenzoyloxy)acetate

SMILES

CCOC(COC(c(c(N)cc([N+]([O-])=O)c1)c1[N+]([O-])=O)=O)=O

InChI

InChI=1S/C11H11N3O8/c1-2-21-9(15)5-22-11(16)10-7(12)3-6(13(17)18)4-8(10)14(19)20/h3-4H,2,5,12H2,1H3

InChI Key

XEUQNERRCPHZHI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01893038

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

313.22

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

0.918

Distribution Coefficient, logD

0.918

Water Solubility, LogSw

-1.56

Polar Surface Area

128.085

Acid Dissociation Constant (pKa)

13.52

Base Dissociation Constant (pKb)

-1.65

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.27

References: we are preparing a list of scientific research reports with 8017-9262 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8017-9262?
Check Price and Availability of 8017-9262, 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 8017-9262 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8017-9262
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8017-9262
  • 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 8017-9262 available by request