R073-0009 Screening compound: 5-phenylcyclohexane-1,3-dione

R073-0009 Screening compound: 5-phenylcyclohexane-1,3-dione
R073-0009 Screening compound: 5-phenylcyclohexane-1,3-dione alternative view

Chemical Structure Depiction of ChemDiv screening compound R073-0009
5-phenylcyclohexane-1,3-dione

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

R073-0009

Molecular Formula

C12H12O2 (C12 H12 O2)

Compound Name

5-phenylcyclohexane-1,3-dione

IUPAC name

5-phenylcyclohexane-13-dione

SMILES

O=C(CC(C1)c2ccccc2)CC1=O

InChI

InChI=1S/C12H12O2/c13-11-6-10(7-12(14)8-11)9-4-2-1-3-5-9/h1-5,10H,6-8H2

InChI Key

UPPYKNLSSLIIAZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00051846

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

188.23

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

1.911

Distribution Coefficient, logD

-2.149

Water Solubility, LogSw

-2.12

Polar Surface Area

26.858

Acid Dissociation Constant (pKa)

3.34

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

R073-0009 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Cardiovascular Library (22201 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cardiovascular
Agro:
  • Agro
Structure:
  • Pool

References: we are preparing a list of scientific research reports with R073-0009 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound R073-0009?
Check Price and Availability of R073-0009, 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 R073-0009 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for R073-0009
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for R073-0009
  • 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 R073-0009 available by request