0067-0006 Screening compound: 2-(4-ethylphenyl)acetic acid

0067-0006 Screening compound: 2-(4-ethylphenyl)acetic acid
0067-0006 Screening compound: 2-(4-ethylphenyl)acetic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 0067-0006
2-(4-ethylphenyl)acetic 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

0067-0006

Molecular Formula

C10H12O2 (C10 H12 O2)

Compound Name

2-(4-ethylphenyl)acetic acid

IUPAC name

2-(4-ethylphenyl)acetic acid

SMILES

CCc1ccc(CC(O)=O)cc1

InChI

InChI=1S/C10H12O2/c1-2-8-3-5-9(6-4-8)7-10(11)12/h3-6H,2,7H2,1H3,(H,11,12)

InChI Key

QMBLXRHXCGJOGU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00605330

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

164.2

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

2.398

Distribution Coefficient, logD

-0.686

Water Solubility, LogSw

-2.25

Polar Surface Area

28.622

Acid Dissociation Constant (pKa)

4.32

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

0067-0006 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

STING Agonist Library (5895 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Cancer
  • Immune system
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • Others
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 0067-0006 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0067-0006?
Check Price and Availability of 0067-0006, 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 0067-0006 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0067-0006
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0067-0006
  • 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 0067-0006 available by request