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Heterocyclic building blocks

Sbb041404

Also known as Thiophene, tetrahydro-3-(methylphenoxy)-, 1,1-dioxide, 3-(2-methylphenoxy)thiolane-1,1-dione, 3-(2-Methylphenoxy)-1lambda~6~-thiolane-1,1-dione

CAS 61604-47-5Formula C11H14O3SMolar mass 226.30 g/mol
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Sbb041404 chemical structure, C11H14O3S, CAS 61604-47-5
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
61604-47-5
Formula
C11H14O3S
Molar mass
226.30 g/mol
HS code
293499
Category
Heterocyclic building blocks

What is Sbb041404?

Plain description, key identifiers and synonyms

Sbb041404 is a chemical substance with the molecular formula C11H14O3S and a molar mass of 226.30 g/mol. Its CAS registry number is 61604-47-5. The IUPAC name is 3-(2-methylphenoxy)thiolane 1,1-dioxide.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
3-(2-methylphenoxy)thiolane 1,1-dioxide
CAS number
61604-47-5 CAS number cross-checked
Molecular formula
C11H14O3S
InChIKey
KPSIRPMVAVWAIW-UHFFFAOYSA-N
InChI
InChI=1S/C11H14O3S/c1-9-4-2-3-5-11(9)14-10-6-7-15(12,13)8-10/h2-5,10H,6-8H2,1H3
SMILES (canonical and isomeric)
CC1=CC=CC=C1OC2CCS(=O)(=O)C2

Synonyms

  • Thiophene, tetrahydro-3-(methylphenoxy)-, 1,1-dioxide
  • 3-(2-methylphenoxy)thiolane-1,1-dione
  • 3-(2-Methylphenoxy)-1lambda~6~-thiolane-1,1-dione

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
226.30 g/molcalc.
Exact mass
226.0664 Dacalc.
LogP (octanol/water)
1.56calc.
Topological polar surface area
43.37 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
2calc.
Heavy atoms
15calc.
Rings
2calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.46calc.
Formal charge
0calc.
Stereocentres
1calc.
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=S1(=O)CCC(Oc2ccccc2)C1

O=S1(=O)CCC(Oc2ccccc2)C1

2 rings, 14 atoms, the 3-Phenoxytetrahydrothiophene 1,1-dioxide ring system.

6 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.

Sbb041404 suppliers

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Sbb041404 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 Sbb041404 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 Sbb041404 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Sbb041404, based on the data on this page

What is Sbb041404?

Sbb041404 is a chemical substance with the molecular formula C11H14O3S and a molar mass of 226.30 g/mol. Its CAS registry number is 61604-47-5. The IUPAC name is 3-(2-methylphenoxy)thiolane 1,1-dioxide.

What is the CAS number of Sbb041404?

The CAS registry number of Sbb041404 is 61604-47-5.

What is the molecular formula and weight of Sbb041404?

The molecular formula of Sbb041404 is C11H14O3S and its molar mass is 226.30 g/mol.

What is Sbb041404 used for?

Known uses and roles of Sbb041404 include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Sbb041404 hazardous?

No GHS hazard classification for Sbb041404 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 Sbb041404?

Sbb041404 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 Sbb041404?

Post a free request on CompoundList and suppliers of Sbb041404 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Sbb041404?

Suppliers quote Sbb041404 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 Sbb041404

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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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