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Isotope-labelled compounds

Propene-d6

Also known as 1,1,2,3,3,3-hexadeuterioprop-1-ene, Propene-d6 (gas), CD3CD=CD2

CAS 1517-52-8Formula C3H6Molar mass 48.12 g/molEC 689-490-0
GHS signal word: Danger. Pictograms: Flammable, Gas under pressure
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Propene-d6 chemical structure, C3H6, CAS 1517-52-8
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
1517-52-8
Formula
C3H6
Molar mass
48.12 g/mol
Physical form
Gas
HS code
284590
Category
Isotope-labelled compounds
Illustrative photo, a gas cylinder on a trolley on a laboratory bench
Typical packagingIllustrative packaging image, not the actual product

What is Propene-d6?

Plain description, key identifiers and synonyms

Propene-d6 is a chemical substance with the molecular formula C3H6 and a molar mass of 48.12 g/mol. Its CAS registry number is 1517-52-8. The IUPAC name is 1,1,2,3,3,3-hexadeuterioprop-1-ene.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
1,1,2,3,3,3-hexadeuterioprop-1-ene
CAS number
1517-52-8 CAS number cross-checked
EC number
689-490-0
Molecular formula
C3H6
InChIKey
QQONPFPTGQHPMA-QNYGJALNSA-N
InChI
InChI=1S/C3H6/c1-3-2/h3H,1H2,2H3/i1D2,2D3,3D
Canonical SMILES
C=CC
Isomeric SMILES
[2H]C(=C([2H])C([2H])([2H])[2H])[2H]

Synonyms

  • 1,1,2,3,3,3-hexadeuterioprop-1-ene
  • Propene-d6 (gas)
  • CD3CD=CD2
  • Propene-d6, 99 atom % D
  • (~2~H_6_)Prop-1-ene

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

Physical form
Gasexp.

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
48.12 g/molcalc.
Exact mass
48.0846 Dacalc.
LogP (octanol/water)
1.19calc.
Topological polar surface area
0 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
0calc.
Rotatable bonds
0calc.
Heavy atoms
3calc.
Rings
0calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.33calc.
Formal charge
0calc.
Stereocentres
0calc.
Lipinski rule of five
Passes (0 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Safety and hazards

GHS classification summary, not a safety data sheet

GHS signal word
Danger
GHS02: Flammable
Flammable
GHS04: Gas under pressure
Gas under pressure

Hazard statements

  • H220Extremely flammable gas.
  • H280Contains gas under pressure, may explode if heated.
Precautionary statements (8)
  • P203Obtain, read and follow all safety instructions before use.
  • P210Keep away from heat, hot surfaces, sparks, open flames and other ignition sources. No smoking.
  • P222Do not allow contact with air.
  • P280Wear protective gloves, protective clothing, eye protection and face protection.
  • P377Leaking gas fire: do not extinguish, unless leak can be stopped safely.
  • P381In case of leakage, eliminate all ignition sources.
  • P403Store in a well-ventilated place.
  • P410 + P403Protect from sunlight. Store in a well-ventilated place.

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

Propene-d6 suppliers

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Propene-d6 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 Propene-d6 is traded under.

HS 2845.90Indicative HS code

Compounds, inorganic or organic, of such isotopes, whether or not chemically defined

World exports in 2024
$2.67B
+19.0% vs 2023, imports $1.67B
2019 to 2024
Top exporters
  1. Ireland55.3%
  2. Hong Kong11.8%
  3. United States10.7%
Top importers
  1. China24.3%
  2. Ireland21.9%
  3. South Korea13.3%
Reported customs values in USD, not prices.Full trade data

The HS code shown for Propene-d6 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Propene-d6, based on the data on this page

What is Propene-d6?

Propene-d6 is a chemical substance with the molecular formula C3H6 and a molar mass of 48.12 g/mol. Its CAS registry number is 1517-52-8. The IUPAC name is 1,1,2,3,3,3-hexadeuterioprop-1-ene.

What is the CAS number of Propene-d6?

The CAS registry number of Propene-d6 is 1517-52-8.

What is the molecular formula and weight of Propene-d6?

The molecular formula of Propene-d6 is C3H6 and its molar mass is 48.12 g/mol.

What is Propene-d6 used for?

Known uses and roles of Propene-d6 include isotope-labelled compounds in research and laboratory.

Is Propene-d6 hazardous?

Propene-d6 carries the GHS signal word "Danger". Main hazards: extremely flammable gas, contains gas under pressure, may explode if heated. This summary is not an SDS, always read the supplier safety data sheet.

What is the HS code of Propene-d6?

Propene-d6 is usually classified under HS code 284590 (Isotopes other than those of heading 2844, compounds, inorganic or organic, of such…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Propene-d6?

Post a free request on CompoundList and suppliers of Propene-d6 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Propene-d6?

Suppliers quote Propene-d6 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 Propene-d6

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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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