0295-0007 Screening compound: N-methyl-3,5-dinitroaniline

0295-0007 Screening compound: N-methyl-3,5-dinitroaniline
0295-0007 Screening compound: N-methyl-3,5-dinitroaniline alternative view

Chemical Structure Depiction of ChemDiv screening compound 0295-0007
N-methyl-3,5-dinitroaniline

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

0295-0007

Molecular Formula

C7H7N3O4 (C7 H7 N3 O4)

Compound Name

N-methyl-3,5-dinitroaniline

IUPAC name

N-methyl-35-dinitroaniline

SMILES

CNc1cc([N+]([O-])=O)cc([N+]([O-])=O)c1

InChI

InChI=1S/C7H7N3O4/c1-8-5-2-6(9(11)12)4-7(3-5)10(13)14/h2-4,8H,1H3

InChI Key

LTIOBKBVEJLDAF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00461254

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

197.15

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.710

Distribution Coefficient, logD

1.710

Water Solubility, LogSw

-1.98

Polar Surface Area

77.658

Acid Dissociation Constant (pKa)

16.85

Base Dissociation Constant (pKb)

0.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

References: we are preparing a list of scientific research reports with 0295-0007 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0295-0007?
Check Price and Availability of 0295-0007, 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 0295-0007 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0295-0007
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0295-0007
  • 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 0295-0007 available by request