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Aliphatic and alicyclic building blocks

Citraldioxyd

Also known as 3-[2-(3,3-Dimethyloxiran-2-yl)ethyl]-3-methyloxirane-2-carbaldehyde

CAS 52561-79-2Formula C10H16O3Molar mass 184.24 g/mol
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Citraldioxyd chemical structure, C10H16O3, CAS 52561-79-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
52561-79-2
Formula
C10H16O3
Molar mass
184.24 g/mol
HS code
291229
Category
Aliphatic and alicyclic building blocks

What is Citraldioxyd?

Plain description, key identifiers and synonyms

Citraldioxyd is a chemical substance with the molecular formula C10H16O3 and a molar mass of 184.24 g/mol. Its CAS registry number is 52561-79-2. The IUPAC name is 3-[2-(3,3-dimethyloxiran-2-yl)ethyl]-3-methyloxirane-2-carbaldehyde.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
3-[2-(3,3-dimethyloxiran-2-yl)ethyl]-3-methyloxirane-2-carbaldehyde
CAS number
52561-79-2 CAS number cross-checked
Molecular formula
C10H16O3
InChIKey
ZERBAVAPQBRAGH-UHFFFAOYSA-N
InChI
InChI=1S/C10H16O3/c1-9(2)7(12-9)4-5-10(3)8(6-11)13-10/h6-8H,4-5H2,1-3H3
SMILES (canonical and isomeric)
CC1(C(O1)CCC2(C(O2)C=O)C)C

Synonyms

  • 3-[2-(3,3-Dimethyloxiran-2-yl)ethyl]-3-methyloxirane-2-carbaldehyde

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
184.24 g/molcalc.
Exact mass
184.1099 Dacalc.
LogP (octanol/water)
1.3calc.
Topological polar surface area
42.13 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
4calc.
Heavy atoms
13calc.
Rings
2calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.9calc.
Formal charge
0calc.
Stereocentres
3calc.
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, C(CC1CO1)C1CO1

C(CC1CO1)C1CO1

2 rings, 8 atoms, the 1,2:5,6-Diepoxyhexane ring system.

15 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.

Citraldioxyd suppliers

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Citraldioxyd 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 Citraldioxyd 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 Citraldioxyd is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

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

What is Citraldioxyd?

Citraldioxyd is a chemical substance with the molecular formula C10H16O3 and a molar mass of 184.24 g/mol. Its CAS registry number is 52561-79-2. The IUPAC name is 3-[2-(3,3-dimethyloxiran-2-yl)ethyl]-3-methyloxirane-2-carbaldehyde.

What is the CAS number of Citraldioxyd?

The CAS registry number of Citraldioxyd is 52561-79-2.

What is the molecular formula and weight of Citraldioxyd?

The molecular formula of Citraldioxyd is C10H16O3 and its molar mass is 184.24 g/mol.

What is Citraldioxyd used for?

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

Is Citraldioxyd hazardous?

No GHS hazard classification for Citraldioxyd 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 Citraldioxyd?

Citraldioxyd 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 Citraldioxyd?

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What is the price of Citraldioxyd?

Suppliers quote Citraldioxyd 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 Citraldioxyd

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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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