1482-0045 Screening compound: 12-(3,5-dimethylphenyl)dodecanoic acid

1482-0045 Screening compound: 12-(3,5-dimethylphenyl)dodecanoic acid
1482-0045 Screening compound: 12-(3,5-dimethylphenyl)dodecanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 1482-0045
12-(3,5-dimethylphenyl)dodecanoic 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

1482-0045

Molecular Formula

C20H32O2 (C20 H32 O2)

Compound Name

12-(3,5-dimethylphenyl)dodecanoic acid

IUPAC name

12-(35-dimethylphenyl)dodecanoic acid

SMILES

Cc1cc(CCCCCCCCCCCC(O)=O)cc(C)c1

InChI

InChI=1S/C20H32O2/c1-17-14-18(2)16-19(15-17)12-10-8-6-4-3-5-7-9-11-13-20(21)22/h14-16H,3-13H2,1-2H3,(H,21,22)

InChI Key

GRDWEVIBBHKSMK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00582464

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

304.47

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

7.272

Distribution Coefficient, logD

4.444

Water Solubility, LogSw

-5.33

Polar Surface Area

28.622

Acid Dissociation Constant (pKa)

4.57

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

65.00

1482-0045 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1482-0045 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1482-0045?
Check Price and Availability of 1482-0045, 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 1482-0045 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1482-0045
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1482-0045
  • 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 1482-0045 available by request