0780-0481A Screening compound: 1-(2,4-dinitrophenyl)-1H-1,2,3-benzotriazole

0780-0481A Screening compound: 1-(2,4-dinitrophenyl)-1H-1,2,3-benzotriazole
0780-0481A Screening compound: 1-(2,4-dinitrophenyl)-1H-1,2,3-benzotriazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 0780-0481A
1-(2,4-dinitrophenyl)-1H-1,2,3-benzotriazole

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

0780-0481A

Molecular Formula

C12H7N5O4 (C12 H7 N5 O4)

Compound Name

1-(2,4-dinitrophenyl)-1H-1,2,3-benzotriazole

IUPAC name

1-(24-dinitrophenyl)-1H-123-benzotriazole

SMILES

[O-][N+](c(cc1)cc([N+]([O-])=O)c1-n1nnc2c1cccc2)=O

InChI

InChI=1S/C12H7N5O4/c18-16(19)8-5-6-11(12(7-8)17(20)21)15-10-4-2-1-3-9(10)13-14-15/h1-7H

InChI Key

KJTTXOXWFXOPHJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00412732

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

285.22

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.394

Distribution Coefficient, logD

2.394

Water Solubility, LogSw

-2.56

Polar Surface Area

91.962

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

1.25

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 0780-0481A chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0780-0481A?
Check Price and Availability of 0780-0481A, 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 0780-0481A you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0780-0481A
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0780-0481A
  • 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 0780-0481A available by request