0149-0084 Screening compound: 3,9-bis[(3,3,4,5,5-pentamethylcyclohexyl)oxy]-2,4,8,10-tetraoxa-3,9-diphosphaspiro[5.5]undecane

0149-0084 Screening compound: 3,9-bis[(3,3,4,5,5-pentamethylcyclohexyl)oxy]-2,4,8,10-tetraoxa-3,9-diphosphaspiro[5.5]undecane
0149-0084 Screening compound: 3,9-bis[(3,3,4,5,5-pentamethylcyclohexyl)oxy]-2,4,8,10-tetraoxa-3,9-diphosphaspiro[5.5]undecane alternative view

Chemical Structure Depiction of ChemDiv screening compound 0149-0084
3,9-bis[(3,3,4,5,5-pentamethylcyclohexyl)oxy]-2,4,8,10-tetraoxa-3,9-diphosphaspiro[5.5]undecane

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

0149-0084

Molecular Formula

C27H50O6P2 (C27 H50 O6 P2)

Compound Name

3,9-bis[(3,3,4,5,5-pentamethylcyclohexyl)oxy]-2,4,8,10-tetraoxa-3,9-diphosphaspiro[5.5]undecane

IUPAC name

39-bis[(33455-pentamethylcyclohexyl)oxy]-24810-tetraoxa-39-diphosphaspiro[5.5]undecane

SMILES

CC(C(C)(C)C1)C(C)(C)CC1OP(OC1)OCC11COP(OC2CC(C)(C)C(C)C(C)(C)C2)OC1

InChI

InChI=1S/C27H50O6P2/c1-19-23(3,4)11-21(12-24(19,5)6)32-34-28-15-27(16-29-34)17-30-35(31-18-27)33-22-13-25(7,8)20(2)26(9,10)14-22/h19-22H,11-18H2,1-10H3

InChI Key

XGBQNNKIDRHDFV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00804778

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

532.64

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.565

Distribution Coefficient, logD

5.565

Water Solubility, LogSw

-5.45

Polar Surface Area

53.021

Acid Dissociation Constant (pKa)

26.86

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 0149-0084 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0149-0084?
Check Price and Availability of 0149-0084, 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 0149-0084 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0149-0084
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0149-0084
  • 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 0149-0084 available by request