0054-0021 Screening compound: 4-(bromomethyl)-4'-pentyl-1,1'-bi(cyclohexane)

0054-0021 Screening compound: 4-(bromomethyl)-4'-pentyl-1,1'-bi(cyclohexane)
0054-0021 Screening compound: 4-(bromomethyl)-4'-pentyl-1,1'-bi(cyclohexane) alternative view

Chemical Structure Depiction of ChemDiv screening compound 0054-0021
4-(bromomethyl)-4'-pentyl-1,1'-bi(cyclohexane)

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

0054-0021

Molecular Formula

C18H33Br (C18 H33 Br)

Compound Name

4-(bromomethyl)-4'-pentyl-1,1'-bi(cyclohexane)

IUPAC name

4-(bromomethyl)-4'-pentyl-11'-bi(cyclohexane)

SMILES

CCCCCC(CC1)CCC1C1CCC(CBr)CC1

InChI

InChI=1S/C18H33Br/c1-2-3-4-5-15-6-10-17(11-7-15)18-12-8-16(14-19)9-13-18/h15-18H,2-14H2,1H3

InChI Key

WDLNUPPGSGTGEQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00981994

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

329.36

Hydrogen Bond Acceptors Count

0.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

n/a

Partition Coefficient, logP

7.501

Distribution Coefficient, logD

7.501

Water Solubility, LogSw

-5.94

Polar Surface Area

0.000

Acid Dissociation Constant (pKa)

26.33

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

100.00

References: we are preparing a list of scientific research reports with 0054-0021 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0054-0021?
Check Price and Availability of 0054-0021, 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 0054-0021 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0054-0021
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0054-0021
  • 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 0054-0021 available by request