0061-0032 Screening compound: (2Z)-2-[(4-chlorophenyl)methylidene]-6-methylcyclohexan-1-one

0061-0032 Screening compound: (2Z)-2-[(4-chlorophenyl)methylidene]-6-methylcyclohexan-1-one
0061-0032 Screening compound: (2Z)-2-[(4-chlorophenyl)methylidene]-6-methylcyclohexan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 0061-0032
(2Z)-2-[(4-chlorophenyl)methylidene]-6-methylcyclohexan-1-one

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

0061-0032

Molecular Formula

C14H15ClO (C14 H15 ClO)

Compound Name

(2Z)-2-[(4-chlorophenyl)methylidene]-6-methylcyclohexan-1-one

IUPAC name

(2Z)-2-[(4-chlorophenyl)methylidene]-6-methylcyclohexan-1-one

SMILES

CC(CCC/C1=C/c(cc2)ccc2Cl)C1=O

InChI

InChI=1S/C14H15ClO/c1-10-3-2-4-12(14(10)16)9-11-5-7-13(15)8-6-11/h5-10H,2-4H2,1H3/t10-/m0/s1

InChI Key

FWDLOXVEAABHRJ-JTQLQIEISA-N

MDL Number (MFCD)

MFCD00600424

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

234.73

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

1

Partition Coefficient, logP

4.175

Distribution Coefficient, logD

4.175

Water Solubility, LogSw

-4.66

Polar Surface Area

13.305

Acid Dissociation Constant (pKa)

21.82

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.70

0061-0032 in Drug Discovery

Included in Screening Libraries

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 0061-0032 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0061-0032?
Check Price and Availability of 0061-0032, 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 0061-0032 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0061-0032
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0061-0032
  • 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 0061-0032 available by request