0099-0144 Screening compound: propan-2-yl 4-hydroxybenzoate

0099-0144 Screening compound: propan-2-yl 4-hydroxybenzoate
0099-0144 Screening compound: propan-2-yl 4-hydroxybenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0099-0144
propan-2-yl 4-hydroxybenzoate

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

0099-0144

Molecular Formula

C10H12O3 (C10 H12 O3)

Compound Name

propan-2-yl 4-hydroxybenzoate

IUPAC name

propan-2-yl 4-hydroxybenzoate

SMILES

CC(C)OC(c(cc1)ccc1O)=O

InChI

InChI=1S/C10H12O3/c1-7(2)13-10(12)8-3-5-9(11)6-4-8/h3-7,11H,1-2H3

InChI Key

CMHMMKSPYOOVGI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00016468

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

180.2

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.266

Distribution Coefficient, logD

2.231

Water Solubility, LogSw

-2.30

Polar Surface Area

38.288

Acid Dissociation Constant (pKa)

8.48

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

0099-0144 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 0099-0144 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0099-0144?
Check Price and Availability of 0099-0144, 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 0099-0144 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0099-0144
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0099-0144
  • 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 0099-0144 available by request