8019-7180 Screening compound: 4,5-dimethoxy-6,7-dinitro-2H-1,3-benzodioxole

8019-7180 Screening compound: 4,5-dimethoxy-6,7-dinitro-2H-1,3-benzodioxole
8019-7180 Screening compound: 4,5-dimethoxy-6,7-dinitro-2H-1,3-benzodioxole alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-7180
4,5-dimethoxy-6,7-dinitro-2H-1,3-benzodioxole

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

8019-7180

Molecular Formula

C9H8N2O8 (C9 H8 N2 O8)

Compound Name

4,5-dimethoxy-6,7-dinitro-2H-1,3-benzodioxole

IUPAC name

45-dimethoxy-67-dinitro-2H-13-benzodioxole

SMILES

COc(c(OC)c1[N+]([O-])=O)c2OCOc2c1[N+]([O-])=O

InChI

InChI=1S/C9H8N2O8/c1-16-6-4(10(12)13)5(11(14)15)7-9(8(6)17-2)19-3-18-7/h3H2,1-2H3

InChI Key

BZVBDXLLPFGLSJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10039165

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

272.17

Hydrogen Bond Acceptors Count

12.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.992

Distribution Coefficient, logD

1.992

Water Solubility, LogSw

-1.88

Polar Surface Area

97.716

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

References: we are preparing a list of scientific research reports with 8019-7180 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-7180?
Check Price and Availability of 8019-7180, 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 8019-7180 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-7180
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-7180
  • 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 8019-7180 available by request