8006-5779 Screening compound: N-(4-acetylphenyl)-2,2,2-trichloroacetamide

8006-5779 Screening compound: N-(4-acetylphenyl)-2,2,2-trichloroacetamide
8006-5779 Screening compound: N-(4-acetylphenyl)-2,2,2-trichloroacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-5779
N-(4-acetylphenyl)-2,2,2-trichloroacetamide

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

8006-5779

Molecular Formula

C10H8Cl3NO2 (C10 H8 Cl3 NO2)

Compound Name

N-(4-acetylphenyl)-2,2,2-trichloroacetamide

IUPAC name

N-(4-acetylphenyl)-222-trichloroacetamide

SMILES

CC(c(cc1)ccc1NC(C(Cl)(Cl)Cl)=O)=O

InChI

InChI=1S/C10H8Cl3NO2/c1-6(15)7-2-4-8(5-3-7)14-9(16)10(11,12)13/h2-5H,1H3,(H,14,16)

InChI Key

QMZOBRFDRYVKNP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00593551

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

280.54

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.696

Distribution Coefficient, logD

1.266

Water Solubility, LogSw

-3.57

Polar Surface Area

37.428

Acid Dissociation Constant (pKa)

5.99

Base Dissociation Constant (pKb)

-6.21

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

References: we are preparing a list of scientific research reports with 8006-5779 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-5779?
Check Price and Availability of 8006-5779, 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 8006-5779 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-5779
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-5779
  • 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 8006-5779 available by request