8013-8599 Screening compound: 3-chloro-4-methoxybenzaldehyde

8013-8599 Screening compound: 3-chloro-4-methoxybenzaldehyde
8013-8599 Screening compound: 3-chloro-4-methoxybenzaldehyde alternative view

Chemical Structure Depiction of ChemDiv screening compound 8013-8599
3-chloro-4-methoxybenzaldehyde

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

8013-8599

Molecular Formula

C8H7ClO2 (C8 H7 ClO2)

Compound Name

3-chloro-4-methoxybenzaldehyde

IUPAC name

3-chloro-4-methoxybenzaldehyde

SMILES

COc(ccc(C=O)c1)c1Cl

InChI

InChI=1S/C8H7ClO2/c1-11-8-3-2-6(5-10)4-7(8)9/h2-5H,1H3

InChI Key

WYVGYYIZXPXHAZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00016601

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

170.6

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

2.120

Distribution Coefficient, logD

2.120

Water Solubility, LogSw

-2.64

Polar Surface Area

22.028

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

8013-8599 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

STING Agonist Library (5895 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic
  • 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 8013-8599 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8013-8599?
Check Price and Availability of 8013-8599, 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 8013-8599 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8013-8599
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8013-8599
  • 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 8013-8599 available by request