0115-0016 Screening compound: 4-pentylcyclohexane-1-carboxylic acid

0115-0016 Screening compound: 4-pentylcyclohexane-1-carboxylic acid
0115-0016 Screening compound: 4-pentylcyclohexane-1-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 0115-0016
4-pentylcyclohexane-1-carboxylic 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

0115-0016

Molecular Formula

C12H22O2 (C12 H22 O2)

Compound Name

4-pentylcyclohexane-1-carboxylic acid

IUPAC name

4-pentylcyclohexane-1-carboxylic acid

SMILES

CCCCCC(CC1)CCC1C(O)=O

InChI

InChI=1S/C12H22O2/c1-2-3-4-5-10-6-8-11(9-7-10)12(13)14/h10-11H,2-9H2,1H3,(H,13,14)

InChI Key

RVLAXPQGTRTHEV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00466238

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

198.31

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

3.810

Distribution Coefficient, logD

1.250

Water Solubility, LogSw

-3.54

Polar Surface Area

28.839

Acid Dissociation Constant (pKa)

4.84

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

91.70

0115-0016 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Akt-Targeted Library (14764 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 0115-0016 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0115-0016?
Check Price and Availability of 0115-0016, 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 0115-0016 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0115-0016
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0115-0016
  • 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 0115-0016 available by request