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Steroids and sterols

2,4-Dihydroxyestrone

Also known as Estra-1,3,5(10)-trien-17-one, 2,3,4-trihydroxy-, (8R,9S,13S,14S)-2,3,4-trihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one, 2,3,4-trihydroxyestra-1(10),2,4-trien-17-one

CAS 42979-86-2Formula C18H22O4Molar mass 302.37 g/mol
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2,4-Dihydroxyestrone chemical structure, C18H22O4, CAS 42979-86-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
42979-86-2
Formula
C18H22O4
Molar mass
302.37 g/mol
HS code
291450
Category
Steroids and sterols

What is 2,4-Dihydroxyestrone?

Plain description, key identifiers and synonyms

2,4-Dihydroxyestrone is a chemical substance with the molecular formula C18H22O4 and a molar mass of 302.37 g/mol. Its CAS registry number is 42979-86-2. The IUPAC name is (8R,9S,13S,14S)-2,3,4-trihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(8R,9S,13S,14S)-2,3,4-trihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
CAS number
42979-86-2 CAS number cross-checked
Molecular formula
C18H22O4
InChIKey
JHMKRVZOGMNBGV-HIONPOMWSA-N
InChI
InChI=1S/C18H22O4/c1-18-7-6-9-10(13(18)4-5-15(18)20)2-3-11-12(9)8-14(19)17(22)16(11)21/h8-10,13,19,21-22H,2-7H2,1H3/t9-,10+,13-,18-/m0/s1
Canonical SMILES
CC12CCC3c4cc(O)c(O)c(O)c4CCC3C1CCC2=O
Isomeric SMILES
C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CCC4=C(C(=C(C=C34)O)O)O

Synonyms

  • Estra-1,3,5(10)-trien-17-one, 2,3,4-trihydroxy-
  • (8R,9S,13S,14S)-2,3,4-trihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
  • 2,3,4-trihydroxyestra-1(10),2,4-trien-17-one

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
302.37 g/molcalc.
Exact mass
302.1518 Dacalc.
LogP (octanol/water)
3.23calc.
Topological polar surface area
77.76 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
0calc.
Heavy atoms
22calc.
Rings
4calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.61calc.
Formal charge
0calc.
Stereocentres
4calc.
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=C1CCC2C1CCC1c3ccccc3CCC12

O=C1CCC2C1CCC1c3ccccc3CCC12

4 rings, 18 atoms.

176 other chemicals 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.

2,4-Dihydroxyestrone suppliers

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2,4-Dihydroxyestrone 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 2,4-Dihydroxyestrone is traded under.

HS 2914.50Indicative HS code

Ketone-phenols and ketones with other oxygen function

World exports in 2024
$438M
+10.9% vs 2023, imports $420M
2019 to 2024
Top exporters
  1. China50.5%
  2. India * partner reported11.6%
  3. United States11.3%
Top importers
  1. United States20.8%
  2. Germany10.0%
  3. Netherlands8.6%

* Partner reported figures, a lower bound.

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

The HS code shown for 2,4-Dihydroxyestrone is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about 2,4-Dihydroxyestrone, based on the data on this page

What is 2,4-Dihydroxyestrone?

2,4-Dihydroxyestrone is a chemical substance with the molecular formula C18H22O4 and a molar mass of 302.37 g/mol. Its CAS registry number is 42979-86-2. The IUPAC name is (8R,9S,13S,14S)-2,3,4-trihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one.

What is the CAS number of 2,4-Dihydroxyestrone?

The CAS registry number of 2,4-Dihydroxyestrone is 42979-86-2.

What is the molecular formula and weight of 2,4-Dihydroxyestrone?

The molecular formula of 2,4-Dihydroxyestrone is C18H22O4 and its molar mass is 302.37 g/mol.

Is 2,4-Dihydroxyestrone hazardous?

No GHS hazard classification for 2,4-Dihydroxyestrone 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 2,4-Dihydroxyestrone?

2,4-Dihydroxyestrone is usually classified under HS code 291450 (Ketone-phenols and ketones with other oxygen function). This is indicative, confirm it with your customs broker before shipping.

Where can I buy 2,4-Dihydroxyestrone?

Post a free request on CompoundList and suppliers of 2,4-Dihydroxyestrone will send you quotes. Your contact details stay private until you accept a quote.

What is the price of 2,4-Dihydroxyestrone?

Suppliers quote 2,4-Dihydroxyestrone 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 2,4-Dihydroxyestrone

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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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