1165-0465 Screening compound: undec-9-ynoic acid

1165-0465 Screening compound: undec-9-ynoic acid
1165-0465 Screening compound: undec-9-ynoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 1165-0465
undec-9-ynoic 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

1165-0465

Molecular Formula

C11H18O2 (C11 H18 O2)

Compound Name

undec-9-ynoic acid

IUPAC name

undec-9-ynoic acid

SMILES

CC#CCCCCCCCC(O)=O

InChI

InChI=1S/C11H18O2/c1-2-3-4-5-6-7-8-9-10-11(12)13/h4-10H2,1H3,(H,12,13)

InChI Key

ZOYDMFOVPQMSPJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00778750

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

182.26

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

2.621

Distribution Coefficient, logD

-0.207

Water Solubility, LogSw

-2.20

Polar Surface Area

28.894

Acid Dissociation Constant (pKa)

4.57

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

72.70

1165-0465 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
  • Cyclic compounds
  • 3D
  • Fragments
Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 1165-0465 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1165-0465?
Check Price and Availability of 1165-0465, 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 1165-0465 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1165-0465
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1165-0465
  • 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 1165-0465 available by request