0781-2866 Screening compound: 4,4-dinitroheptanedioic acid

0781-2866 Screening compound: 4,4-dinitroheptanedioic acid
0781-2866 Screening compound: 4,4-dinitroheptanedioic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 0781-2866
4,4-dinitroheptanedioic acid

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

0781-2866

Molecular Formula

C7H10N2O8 (C7 H10 N2 O8)

Compound Name

4,4-dinitroheptanedioic acid

IUPAC name

44-dinitroheptanedioic acid

SMILES

[O-][N+](C(CCC(O)=O)(CCC(O)=O)[N+]([O-])=O)=O

InChI

InChI=1S/C7H10N2O8/c10-5(11)1-3-7(8(14)15,9(16)17)4-2-6(12)13/h1-4H2,(H,10,11)(H,12,13)

InChI Key

WVXNFQGAMQFCSX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00134974

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

250.17

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

-1.081

Distribution Coefficient, logD

-3.462

Water Solubility, LogSw

-0.37

Polar Surface Area

126.515

Acid Dissociation Constant (pKa)

5.02

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

71.40

References: we are preparing a list of scientific research reports with 0781-2866 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0781-2866?
Check Price and Availability of 0781-2866, 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 0781-2866 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0781-2866
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0781-2866
  • 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 0781-2866 available by request