0233-0028 Screening compound: 1,2,4-trichloro-5-(pentyloxy)benzene

0233-0028 Screening compound: 1,2,4-trichloro-5-(pentyloxy)benzene
0233-0028 Screening compound: 1,2,4-trichloro-5-(pentyloxy)benzene alternative view

Chemical Structure Depiction of ChemDiv screening compound 0233-0028
1,2,4-trichloro-5-(pentyloxy)benzene

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

0233-0028

Molecular Formula

C11H13Cl3O (C11 H13 Cl3 O)

Compound Name

1,2,4-trichloro-5-(pentyloxy)benzene

IUPAC name

124-trichloro-5-(pentyloxy)benzene

SMILES

CCCCCOc(c(Cl)c1)cc(Cl)c1Cl

InChI

InChI=1S/C11H13Cl3O/c1-2-3-4-5-15-11-7-9(13)8(12)6-10(11)14/h6-7H,2-5H2,1H3

InChI Key

GGGAOBYRQNIPBO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00474663

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

267.58

Hydrogen Bond Acceptors Count

1.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

1

Partition Coefficient, logP

5.927

Distribution Coefficient, logD

5.927

Water Solubility, LogSw

-6.19

Polar Surface Area

7.743

Acid Dissociation Constant (pKa)

27.56

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

0233-0028 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 0233-0028 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0233-0028?
Check Price and Availability of 0233-0028, 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 0233-0028 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0233-0028
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0233-0028
  • 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 0233-0028 available by request