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Heterocyclic building blocks

Bergaptol

Also known as 5-Hydroxypsoralen, 4-Hydroxy-7H-furo[3,2-g]chromen-7-one, 5-Hydroxyfuranocoumarin

CAS 486-60-2Formula C11H6O4Molar mass 202.17 g/molEC 803-802-6
GHS signal word: Warning. Pictograms: Harmful or irritant 7 suppliers listed
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Bergaptol chemical structure, C11H6O4, CAS 486-60-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
486-60-2
Formula
C11H6O4
Molar mass
202.17 g/mol
EC number
803-802-6
HS code
293220
Category
Heterocyclic building blocks

What is Bergaptol?

Plain description, key identifiers and synonyms

Bergaptol is a member of psoralens and a 5-hydroxyfurocoumarin. It is a conjugate acid of a bergaptol(1-).

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
4-hydroxyfuro[3,2-g]chromen-7-one
CAS number
486-60-2 CAS number cross-checked
EC number
803-802-6
Molecular formula
C11H6O4
UNII
KTC8ANI30F
MDL number
MFCD00210479
InChIKey
GIJHDGJRTUSBJR-UHFFFAOYSA-N
InChI
InChI=1S/C11H6O4/c12-10-2-1-6-9(15-10)5-8-7(11(6)13)3-4-14-8/h1-5,13H
SMILES (canonical and isomeric)
C1=CC(=O)OC2=CC3=C(C=CO3)C(=C21)O

Synonyms

  • 5-Hydroxypsoralen
  • 4-Hydroxy-7H-furo[3,2-g]chromen-7-one
  • 5-Hydroxyfuranocoumarin
  • 4-hydroxyfuro[3,2-g]chromen-7-one
  • 7H-Furo[3,2-g][1]benzopyran-7-one, 4-hydroxy-
  • 7H-Furo(3,2-g)(1)benzopyran-7-one, 4-hydroxy-
  • 5-hydroxy-2H-furo[3,2-g]chromen-2-one
  • 4-Hydroxy-7H-furo(3,2-g)chromen-7-one
  • 4-hydroxyfuro(3,2-g)chromen-7-one
  • 5-hydroxy-2H-furo(3,2-g)chromen-2-one
  • 4-Hydroxybergapten
  • Psoralin, 5-hydroxy-
  • 5-Hydroxy-6,7-furanocoumarin
  • 4-Hydroxy-7H-furo[3,2-g][1]benzopyran-7-one
  • 5-Hydroxypsoralen, 4-Hydroxybergapten
  • 4-oxidanylfuro[3,2-g]chromen-7-one
  • Bergaptols
  • 5-Hydroxyfurocoumarin
  • Bergaptol (Standard)
  • 5-Hydroxy-psoralin
  • 7H-Furo[3, 4-hydroxy-
  • Bergaptol, analytical standard
  • 7H-Furo(3,2-g)(1)benzopyran-7-one, 4-hydroxy- (8CI)(9CI)
  • 4-Hydroxybergapten, 5-Hydroxypsoralen
  • 5-hydroxyfurano[3,2-g]chromen-2-one
Show all 30 synonyms
  • 4-Hydroxy-7H-furo[3,2-g]chromen-7-one #
  • 4-Hydroxy7H-furo[3,2-g][1]benzopyran-7-one
  • 4-hydroxy-7H-furo[3,2-g]chromen-7-one [M+H]+
  • {7H-Furo[3,} {2-g][1]benzopyran-7-one,} 4-hydroxy-
  • 4-Hydroxy-7H-furo[3,2-g]chromen-7-one (ACD/Name 4.0)

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
202.17 g/molcalc.
Exact mass
202.0266 Dacalc.
LogP (octanol/water)
2.24calc.
Topological polar surface area
63.58 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
0calc.
Heavy atoms
15calc.
Rings
3calc.
Aromatic rings
3calc.
Fraction sp3 carbons
0calc.
Formal charge
0calc.
Stereocentres
0calc.
Lipinski rule of five
Passes (0 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=c1ccc2cc3ccoc3cc2o1

O=c1ccc2cc3ccoc3cc2o1

3 rings, 14 atoms, the Psoralen ring system.

431 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

GHS signal word
Warning
GHS07: Harmful or irritant
Harmful or irritant

Hazard statements

  • H302Harmful if swallowed.
  • H319Causes serious eye irritation.
Precautionary statements (9)
  • P264Wash skin thoroughly after handling.
  • P264 + P265Wash skin thoroughly after handling. Do not touch eyes.
  • P270Do not eat, drink or smoke when using this product.
  • P280Wear protective gloves, protective clothing, eye protection and face protection.
  • P301 + P317If swallowed: Get medical help.
  • P305 + P351 + P338If in eyes: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
  • P330Rinse mouth.
  • P337 + P317If eye irritation persists: Get medical help.
  • P501Dispose of contents and container in accordance with local regulations.

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

Full safety data and first aid

Bergaptol suppliers

Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings

All 7 suppliers
7 of 7 offers

Suppliers marked Unclaimed profile have not claimed their profile yet. They are not verified by CompoundList, their offers are price on request and details may have changed, so please confirm them with the supplier. Company representatives can claim a profile with a business email on the company's own website domain. Our team verifies each claim and sends the result by email.

Where suppliers are based

7 suppliers in 2 countries

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Bergaptol price

Indicative price range per kg from live supplier offers

No published prices right now

Suppliers quote this chemical on request. Send one free request and compare quotes side by side.

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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 Bergaptol is traded under.

HS 2932.20Indicative HS code

Lactones

World exports in 2024
$1.97B
−4.7% vs 2023, imports $2.07B
2019 to 2024
Top exporters
  1. China56.3%
  2. India * partner reported7.4%
  3. Germany7.3%
Top importers
  1. United States14.2%
  2. India * partner reported13.5%
  3. Brazil8.5%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

Quick answers about Bergaptol, based on the data on this page

What is Bergaptol?

Bergaptol is a member of psoralens and a 5-hydroxyfurocoumarin. It is a conjugate acid of a bergaptol(1-).

What is the CAS number of Bergaptol?

The CAS registry number of Bergaptol is 486-60-2.

What is the molecular formula and weight of Bergaptol?

The molecular formula of Bergaptol is C11H6O4 and its molar mass is 202.17 g/mol.

What is Bergaptol used for?

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

Is Bergaptol hazardous?

Bergaptol carries the GHS signal word "Warning". Main hazards: harmful if swallowed, causes serious eye irritation. This summary is not an SDS, always read the supplier safety data sheet.

What is the HS code of Bergaptol?

Bergaptol is usually classified under HS code 293220 (Lactones). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Bergaptol?

CompoundList lists 7 suppliers of Bergaptol in China and United States. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of Bergaptol?

Suppliers quote Bergaptol 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 Bergaptol

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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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