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Heterocyclic building blocks

Hexathiepane

Also known as 1,2,3,4,5,6-hexathiepane, 1,2,3,4,5,6-Hexathiacycloheptane

CAS 17233-71-5Formula CH2S6Molar mass 206.43 g/mol
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Hexathiepane chemical structure, CH2S6, CAS 17233-71-5
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
17233-71-5
Formula
CH2S6
Molar mass
206.43 g/mol
HS code
293499
Category
Heterocyclic building blocks

What is Hexathiepane?

Plain description, key identifiers and synonyms

1,2,3,4,5,6-Hexathiepane is an organic heterocyclic compound.

Hexathiepane is a hexathiepane is found in mushrooms. Hexathiepane is a minor constituent of Lentinus edodes (shiitake.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
hexathiepane
CAS number
17233-71-5 CAS number cross-checked
Molecular formula
CH2S6
InChIKey
JMYWPEQXUQGQNF-UHFFFAOYSA-N
InChI
InChI=1S/CH2S6/c1-2-4-6-7-5-3-1/h1H2
SMILES (canonical and isomeric)
C1SSSSSS1

Synonyms

  • 1,2,3,4,5,6-hexathiepane
  • 1,2,3,4,5,6-Hexathiacycloheptane

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
206.43 g/molcalc.
Exact mass
205.8481 Dacalc.
LogP (octanol/water)
3.93calc.
Topological polar surface area
0 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
6calc.
Rotatable bonds
0calc.
Heavy atoms
7calc.
Rings
1calc.
Aromatic rings
0calc.
Fraction sp3 carbons
1calc.
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, C1SSSSSS1

C1SSSSSS1

1 ring, 7 atoms. This chemical is the scaffold itself.

No other chemical in our database has 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.

Hexathiepane suppliers

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Hexathiepane 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 Hexathiepane is traded under.

HS 2934.99Indicative HS code

Nucleic acids and their salts, other heterocyclic compounds, not elsewhere classified in heading 2934

World exports in 2024
$26.7B
+15.0% vs 2023, imports $26.3B
2019 to 2024
Top exporters
  1. Ireland26.3%
  2. China15.7%
  3. Singapore10.3%
Top importers
  1. United States24.5%
  2. Germany23.1%
  3. Japan4.5%
Reported customs values in USD, not prices.Full trade data

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

Frequently asked questions

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

What is Hexathiepane?

1,2,3,4,5,6-Hexathiepane is an organic heterocyclic compound.

What is the CAS number of Hexathiepane?

The CAS registry number of Hexathiepane is 17233-71-5.

What is the molecular formula and weight of Hexathiepane?

The molecular formula of Hexathiepane is CH2S6 and its molar mass is 206.43 g/mol.

What is Hexathiepane used for?

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

Is Hexathiepane hazardous?

No GHS hazard classification for Hexathiepane 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 Hexathiepane?

Hexathiepane is usually classified under HS code 293499 (Nucleic acids and their salts, whether or not chemically defined, other heterocyclic…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Hexathiepane?

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

What is the price of Hexathiepane?

Suppliers quote Hexathiepane 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 Hexathiepane

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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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