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Screening compounds

Isocopalendial

Also known as (1S,4aR,4bS,8aS,10aR)-4b,8,8,10a-tetramethyl-4,4a,5,6,7,8a,9,10-octahydro-1H-phenanthrene-1,2-dicarbaldehyde, 8-Methylpodocarp-12-ene-13,14beta-dicarbaldehyde

CAS 84807-61-4Formula C20H30O2Molar mass 302.46 g/mol
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Isocopalendial chemical structure, C20H30O2, CAS 84807-61-4
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
84807-61-4
Formula
C20H30O2
Molar mass
302.46 g/mol
HS code
291229
Category
Screening compounds

What is Isocopalendial?

Plain description, key identifiers and synonyms

Isocopalendial is a chemical substance with the molecular formula C20H30O2 and a molar mass of 302.46 g/mol. Its CAS registry number is 84807-61-4. The IUPAC name is (1S,4aR,4bS,8aS,10aR)-4b,8,8,10a-tetramethyl-4,4a,5,6,7,8a,9,10-octahydro-1H-phenanthrene-1,2-dicarbaldehyde.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(1S,4aR,4bS,8aS,10aR)-4b,8,8,10a-tetramethyl-4,4a,5,6,7,8a,9,10-octahydro-1H-phenanthrene-1,2-dicarbaldehyde
CAS number
84807-61-4 CAS number cross-checked
Molecular formula
C20H30O2
InChIKey
NPOWRDFGFIYMIY-ORZNMBHWSA-N
InChI
InChI=1S/C20H30O2/c1-18(2)9-5-10-20(4)16(18)8-11-19(3)15(13-22)14(12-21)6-7-17(19)20/h6,12-13,15-17H,5,7-11H2,1-4H3/t15-,16+,17+,19+,20+/m1/s1
Canonical SMILES
CC1(C)CCCC2(C)C1CCC1(C)C(C=O)C(C=O)=CCC12
Isomeric SMILES
C[C@]12CCCC([C@@H]1CC[C@@]3([C@@H]2CC=C([C@H]3C=O)C=O)C)(C)C

Synonyms

  • (1S,4aR,4bS,8aS,10aR)-4b,8,8,10a-tetramethyl-4,4a,5,6,7,8a,9,10-octahydro-1H-phenanthrene-1,2-dicarbaldehyde
  • 8-Methylpodocarp-12-ene-13,14beta-dicarbaldehyde

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
302.46 g/molcalc.
Exact mass
302.2246 Dacalc.
LogP (octanol/water)
4.58calc.
Topological polar surface area
34.14 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
2calc.
Rotatable bonds
2calc.
Heavy atoms
22calc.
Rings
3calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.8calc.
Formal charge
0calc.
Stereocentres
5calc.
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, C1=CCC2C(C1)CCC1CCCCC12

C1=CCC2C(C1)CCC1CCCCC12

3 rings, 14 atoms.

4 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.

Isocopalendial suppliers

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Isocopalendial 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 Isocopalendial is traded under.

HS 2912.29Indicative HS code

Cyclic aldehydes without other oxygen function, other

World exports in 2024
$435M
+19.0% vs 2023, imports $484M
2019 to 2024
Top exporters
  1. China19.5%
  2. Japan17.4%
  3. India * partner reported13.0%
Top importers
  1. United States22.5%
  2. China9.2%
  3. Singapore8.4%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

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

What is Isocopalendial?

Isocopalendial is a chemical substance with the molecular formula C20H30O2 and a molar mass of 302.46 g/mol. Its CAS registry number is 84807-61-4. The IUPAC name is (1S,4aR,4bS,8aS,10aR)-4b,8,8,10a-tetramethyl-4,4a,5,6,7,8a,9,10-octahydro-1H-phenanthrene-1,2-dicarbaldehyde.

What is the CAS number of Isocopalendial?

The CAS registry number of Isocopalendial is 84807-61-4.

What is the molecular formula and weight of Isocopalendial?

The molecular formula of Isocopalendial is C20H30O2 and its molar mass is 302.46 g/mol.

What is Isocopalendial used for?

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

Is Isocopalendial hazardous?

No GHS hazard classification for Isocopalendial 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 Isocopalendial?

Isocopalendial is usually classified under HS code 291229 (Cyclic aldehydes without other oxygen function, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Isocopalendial?

Post a free request on CompoundList and suppliers of Isocopalendial will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Isocopalendial?

Suppliers quote Isocopalendial 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 Isocopalendial

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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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