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Ligands for catalysis

Ad-BippyPhos

Also known as 5-(di(adamantan-1-yl)phosphino)-1',3',5'-triphenyl-1'H-1,4'-bipyrazole, 1,4'-Bi-1H-pyrazole, 5-[bis(tricyclo[3.3.1.13,7]dec-1-yl)phosphino]-1',3',5'-triphenyl-, bis(1-adamantyl)-[2-(1,3,5-triphenylpyrazol-4-yl)pyrazol-3-yl]phosphane

CAS 1239478-87-5Formula C44H47N4PMolar mass 662.86 g/mol
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Ad-BippyPhos chemical structure, C44H47N4P, CAS 1239478-87-5
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
1239478-87-5
Formula
C44H47N4P
Molar mass
662.86 g/mol
HS code
293319
Category
Ligands for catalysis

What is Ad-BippyPhos?

Plain description, key identifiers and synonyms

Ad-BippyPhos is a chemical substance with the molecular formula C44H47N4P and a molar mass of 662.86 g/mol. Its CAS registry number is 1239478-87-5. The IUPAC name is bis(1-adamantyl)-[2-(1,3,5-triphenylpyrazol-4-yl)pyrazol-3-yl]phosphane.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
bis(1-adamantyl)-[2-(1,3,5-triphenylpyrazol-4-yl)pyrazol-3-yl]phosphane
CAS number
1239478-87-5
Molecular formula
C44H47N4P
MDL number
MFCD22200502
InChIKey
IHFBOUNFWVRWAQ-UHFFFAOYSA-N
InChI
InChI=1S/C44H47N4P/c1-4-10-36(11-5-1)40-42(41(37-12-6-2-7-13-37)47(46-40)38-14-8-3-9-15-38)48-39(16-17-45-48)49(43-24-30-18-31(25-43)20-32(19-30)26-43)44-27-33-21-34(28-44)23-35(22-33)29-44/h1-17,30-35H,18-29H2
SMILES (canonical and isomeric)
C1C2CC3CC1CC(C2)(C3)P(C4=CC=NN4C5=C(N(N=C5C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=CC=C8)C91CC2CC(C9)CC(C2)C1

Synonyms

  • 5-(di(adamantan-1-yl)phosphino)-1',3',5'-triphenyl-1'H-1,4'-bipyrazole
  • 1,4'-Bi-1H-pyrazole, 5-[bis(tricyclo[3.3.1.13,7]dec-1-yl)phosphino]-1',3',5'-triphenyl-
  • bis(1-adamantyl)-[2-(1,3,5-triphenylpyrazol-4-yl)pyrazol-3-yl]phosphane
  • 5-[Bis(tricyclo[3.3.1.13,7]dec-1-yl)phosphino]-1',3',5'-triphenyl-1,4'-bi-1H-pyrazole
  • 5-[Di(1-adamantyl)phosphino]-1',3',5'-triphenyl-1'H-[1,4']bipyrazole
  • 5-[Di(1-adamantyl)phosphino](1,3,5-triphenyl-1H-pyrazol-4-yl)-1H-pyrazole
  • 5-(di(adamantan-1-yl)phosphaneyl)-1',3',5'-triphenyl-1'H-1,4'-bipyrazole
  • 5-[Bis(1-adamantyl)phosphino]-1',3',5'-triphenyl-1,4'-bi-1H-pyrazole
  • 5-[bis(adamantan-1-yl)phosphanyl]-1',3',5'-triphenyl-1'H-1,4'-bipyrazole
  • 5-[Di(1-adamantyl)phosphino]-1',3',5'-triphenyl-1'H-[1,4']bipyrazole, 97%

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
662.86 g/molcalc.
Exact mass
662.3538 Dacalc.
LogP (octanol/water)
10.44calc.
Topological polar surface area
35.64 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
2calc.
Rotatable bonds
7calc.
Heavy atoms
49calc.
Rings
13calc.
Aromatic rings
5calc.
Fraction sp3 carbons
0.46calc.
Formal charge
0calc.
Stereocentres
0calc.
Lipinski rule of five
Fails (2 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, c1ccc(-c2nn(-c3ccccc3)c(-c3ccccc3)c2-n2nccc2P(C23CC4CC(CC(C4)C2)C3)C23CC4CC(CC(C4)C2)C3)cc1

c1ccc(-c2nn(-c3ccccc3)c(-c3ccccc3)c2-n2nccc2P(C23CC4CC(CC(C4)C2)C3)C23CC4CC(CC(C4)C2)C3)cc1

13 rings, 49 atoms. This chemical is the scaffold itself.

1 other chemical share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Ad-BippyPhos suppliers

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  • Dalchem
    RussiaUnclaimed profile
    Ad-BippyPhosGrade, purity and minimum order on request
    Price on request
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Ad-BippyPhos price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

Applications are not documented for this substance yet. Suppliers often describe uses on their product pages, linked in the suppliers list above.

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Ad-BippyPhos is traded under.

HS 2933.19Indicative HS code

Compounds containing an unfused pyrazole ring (whether or not hydrogenated) in the…

World exports in 2024
$3.44B
−22.6% vs 2023, imports $6.66B
2019 to 2024
Top exporters
  1. China21.6%
  2. Switzerland * partner reported20.5%
  3. Germany19.0%
Top importers
  1. Slovenia38.4%
  2. Portugal14.1%
  3. Brazil13.0%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Ad-BippyPhos is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Ad-BippyPhos, based on the data on this page

What is Ad-BippyPhos?

Ad-BippyPhos is a chemical substance with the molecular formula C44H47N4P and a molar mass of 662.86 g/mol. Its CAS registry number is 1239478-87-5. The IUPAC name is bis(1-adamantyl)-[2-(1,3,5-triphenylpyrazol-4-yl)pyrazol-3-yl]phosphane.

What is the CAS number of Ad-BippyPhos?

The CAS registry number of Ad-BippyPhos is 1239478-87-5.

What is the molecular formula and weight of Ad-BippyPhos?

The molecular formula of Ad-BippyPhos is C44H47N4P and its molar mass is 662.86 g/mol.

Is Ad-BippyPhos hazardous?

No GHS hazard classification for Ad-BippyPhos is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Ad-BippyPhos?

Ad-BippyPhos is usually classified under HS code 293319 (Compounds containing an unfused pyrazole ring (whether or not hydrogenated) in the…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Ad-BippyPhos?

CompoundList lists 1 supplier of Ad-BippyPhos in Russia. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of Ad-BippyPhos?

Suppliers quote Ad-BippyPhos on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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