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Screening compounds

Diphloretin phosphate

Also known as bis[4-[3-oxo-3-(2,4,6-trihydroxyphenyl)propyl]phenyl] hydrogen phosphate, Bis{4-[3-oxo-3-(2,4,6-trihydroxyphenyl)propyl]phenyl} hydrogen phosphate, 1-Propanone, 3,3'-(phosphinicobis(oxy-4,1-phenylene))bis(1-(2,4,6-trihydroxyphenyl)-

CAS 39201-04-2Formula C30H27O12PMolar mass 610.51 g/mol
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Diphloretin phosphate chemical structure, C30H27O12P, CAS 39201-04-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
39201-04-2
Formula
C30H27O12P
Molar mass
610.51 g/mol
HS code
291990
Category
Screening compounds

What is Diphloretin phosphate?

Plain description, key identifiers and synonyms

Diphloretin phosphate is a chemical substance with the molecular formula C30H27O12P and a molar mass of 610.51 g/mol. Its CAS registry number is 39201-04-2. The IUPAC name is bis[4-[3-oxo-3-(2,4,6-trihydroxyphenyl)propyl]phenyl] hydrogen phosphate.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
bis[4-[3-oxo-3-(2,4,6-trihydroxyphenyl)propyl]phenyl] hydrogen phosphate
CAS number
39201-04-2 CAS number cross-checked
Molecular formula
C30H27O12P
InChIKey
NGZJJNCWIBSKQW-UHFFFAOYSA-N
InChI
InChI=1S/C30H27O12P/c31-19-13-25(35)29(26(36)14-19)23(33)11-5-17-1-7-21(8-2-17)41-43(39,40)42-22-9-3-18(4-10-22)6-12-24(34)30-27(37)15-20(32)16-28(30)38/h1-4,7-10,13-16,31-32,35-38H,5-6,11-12H2,(H,39,40)
SMILES (canonical and isomeric)
C1=CC(=CC=C1CCC(=O)C2=C(C=C(C=C2O)O)O)OP(=O)(O)OC3=CC=C(C=C3)CCC(=O)C4=C(C=C(C=C4O)O)O

Synonyms

  • bis[4-[3-oxo-3-(2,4,6-trihydroxyphenyl)propyl]phenyl] hydrogen phosphate
  • Bis{4-[3-oxo-3-(2,4,6-trihydroxyphenyl)propyl]phenyl} hydrogen phosphate
  • 1-Propanone, 3,3'-(phosphinicobis(oxy-4,1-phenylene))bis(1-(2,4,6-trihydroxyphenyl)-

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
610.51 g/molcalc.
Exact mass
610.124 Dacalc.
LogP (octanol/water)
5.11calc.
Topological polar surface area
211.3 Ųcalc.
Hydrogen bond donors
7calc.
Hydrogen bond acceptors
11calc.
Rotatable bonds
12calc.
Heavy atoms
43calc.
Rings
4calc.
Aromatic rings
4calc.
Fraction sp3 carbons
0.13calc.
Formal charge
0calc.
Stereocentres
0calc.
Lipinski rule of five
Fails (4 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, O=C(CCc1ccc(O[PH](=O)Oc2ccc(CCC(=O)c3ccccc3)cc2)cc1)c1ccccc1

O=C(CCc1ccc(O[PH](=O)Oc2ccc(CCC(=O)c3ccccc3)cc2)cc1)c1ccccc1

4 rings, 36 atoms.

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.

Diphloretin phosphate suppliers

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Diphloretin phosphate 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

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 Diphloretin phosphate is traded under.

HS 2919.90Indicative HS code

Phosphoric, and their salts, including lactophosphates, their halogenated, sulphonated, nitrated…

World exports in 2024
$940M
−0.7% vs 2023, imports $863M
2019 to 2024
Top exporters
  1. China55.6%
  2. Germany10.6%
  3. Italy6.2%
Top importers
  1. United States15.8%
  2. South Korea10.1%
  3. Germany6.4%
Reported customs values in USD, not prices.Full trade data

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

Frequently asked questions

Quick answers about Diphloretin phosphate, based on the data on this page

What is Diphloretin phosphate?

Diphloretin phosphate is a chemical substance with the molecular formula C30H27O12P and a molar mass of 610.51 g/mol. Its CAS registry number is 39201-04-2. The IUPAC name is bis[4-[3-oxo-3-(2,4,6-trihydroxyphenyl)propyl]phenyl] hydrogen phosphate.

What is the CAS number of Diphloretin phosphate?

The CAS registry number of Diphloretin phosphate is 39201-04-2.

What is the molecular formula and weight of Diphloretin phosphate?

The molecular formula of Diphloretin phosphate is C30H27O12P and its molar mass is 610.51 g/mol.

What is Diphloretin phosphate used for?

Known uses and roles of Diphloretin phosphate include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Diphloretin phosphate hazardous?

No GHS hazard classification for Diphloretin phosphate 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 Diphloretin phosphate?

Diphloretin phosphate is usually classified under HS code 291990 (Phosphoric esters and their salts, including lactophosphates, their halogenated…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Diphloretin phosphate?

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What is the price of Diphloretin phosphate?

Suppliers quote Diphloretin phosphate 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

Practical guides that help when you source, ship or handle Diphloretin phosphate

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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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