8009-3751 Screening compound: 2,4-dichloro-5-(chlorosulfonyl)benzoic acid

8009-3751 Screening compound: 2,4-dichloro-5-(chlorosulfonyl)benzoic acid
8009-3751 Screening compound: 2,4-dichloro-5-(chlorosulfonyl)benzoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 8009-3751
2,4-dichloro-5-(chlorosulfonyl)benzoic 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

8009-3751

Molecular Formula

C7H3Cl3O4S (C7 H3 Cl3 O4 S)

Compound Name

2,4-dichloro-5-(chlorosulfonyl)benzoic acid

IUPAC name

24-dichloro-5-(chlorosulfonyl)benzoic acid

SMILES

OC(c(c(Cl)c1)cc(S(Cl)(=O)=O)c1Cl)=O

InChI

InChI=1S/C7H3Cl3O4S/c8-4-2-5(9)6(15(10,13)14)1-3(4)7(11)12/h1-2H,(H,11,12)

InChI Key

MPUNAIYDVXJQBJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00486543

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

289.52

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.300

Distribution Coefficient, logD

-3.009

Water Solubility, LogSw

-2.93

Polar Surface Area

59.300

Acid Dissociation Constant (pKa)

2.09

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8009-3751 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments

References: we are preparing a list of scientific research reports with 8009-3751 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8009-3751?
Check Price and Availability of 8009-3751, 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 8009-3751 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8009-3751
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8009-3751
  • 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 8009-3751 available by request