8007-1295 Screening compound: 2,2,2-trichloro-1-(4-methoxyphenyl)ethyl 2-phenoxyacetate

8007-1295 Screening compound: 2,2,2-trichloro-1-(4-methoxyphenyl)ethyl 2-phenoxyacetate
8007-1295 Screening compound: 2,2,2-trichloro-1-(4-methoxyphenyl)ethyl 2-phenoxyacetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8007-1295
2,2,2-trichloro-1-(4-methoxyphenyl)ethyl 2-phenoxyacetate

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

8007-1295

Molecular Formula

C17H15Cl3O4 (C17 H15 Cl3 O4)

Compound Name

2,2,2-trichloro-1-(4-methoxyphenyl)ethyl 2-phenoxyacetate

IUPAC name

222-trichloro-1-(4-methoxyphenyl)ethyl 2-phenoxyacetate

SMILES

COc1ccc(C(C(Cl)(Cl)Cl)OC(COc2ccccc2)=O)cc1

InChI

InChI=1S/C17H15Cl3O4/c1-22-13-9-7-12(8-10-13)16(17(18,19)20)24-15(21)11-23-14-5-3-2-4-6-14/h2-10,16H,11H2,1H3/t16-/m1/s1

InChI Key

OCBMQLOOPBZJJR-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD00227147

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.66

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.605

Distribution Coefficient, logD

4.605

Water Solubility, LogSw

-4.87

Polar Surface Area

34.820

Acid Dissociation Constant (pKa)

24.85

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

23.53

References: we are preparing a list of scientific research reports with 8007-1295 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8007-1295?
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What is the minimum amount of 8007-1295 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8007-1295
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8007-1295
  • 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 8007-1295 available by request