2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one

C15H21NO2S

CAS71868-10-5
GHS08 Gefahrensymbol: Gesundheitsgefahr – Gesundheitsgefahr
GHS07 Gefahrensymbol: Gesundheitsschädlich/Reizend – Ausrufezeichen
GHS09 Gefahrensymbol: Umweltgefährlich – Umwelt
Danger

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Identification

CAS Number
71868-10-5
EC Number
400-600-6
UN Number
3077
Index Number
606-041-00-6
PubChem CID
92387

Physical-chemical properties

Molecular Formula
C15H21NO2S
Molar Mass
279.40 g/mol
IUPAC Name
2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one

Chemical Identifiers

InChI
InChI=1S/C15H21NO2S/c1-15(2,16-8-10-18-11-9-16)14(17)12-4-6-13(19-3)7-5-12/h4-7H,8-11H2,1-3H3
InChI Key
LWRBVKNFOYUCNP-UHFFFAOYSA-N

Overview

2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one (CAS 71868-10-5) is an organic compound featuring morpholine and methylsulfanyl functional groups with complex molecular structure. This specialized organic compound, with the molecular formula C15H21NO2S and a molecular weight of 279.4 g/mol, represents a sophisticated chemical structure combining ketone, morpholine, and aromatic sulfide functionalities. The presence of the methylsulfanyl group attached to the phenyl ring, along with the morpholine substituent, creates unique chemical properties that distinguish this compound in industrial applications. The EC number 400-600-6 facilitates its identification and regulatory compliance within European chemical markets. The compound presents significant safety considerations, classified as Reproductive Toxicity Category 1B and Acute Toxicity Category 4, requiring careful handling protocols. The GHS08 and GHS07 pictograms indicate serious health hazards, while GHS09 signifies environmental concerns, particularly regarding aquatic chronic toxicity. Its ADR Class 9 classification designates it as a miscellaneous dangerous substance for transport purposes, necessitating specialized logistics handling. Industrial applications typically involve its use as an intermediate in pharmaceutical synthesis, specialty polymer production, and advanced materials manufacturing. The morpholine ring system makes it valuable in applications where both hydrophilic and lipophilic properties are required, similar to how compounds like 4-[(4-amino-3-chlorophenyl)methyl]-2-chloroaniline serve in pharmaceutical intermediates. Unlike simpler inorganic compounds such as cobalt(2+) sulfate, this organic structure offers specific reactivity patterns essential for complex synthetic pathways. OYSI provides this technical-grade compound to qualified industrial customers across Europe, supporting advanced chemical manufacturing requirements with comprehensive safety documentation and regulatory compliance support.

Safety & Classification

Danger
Classification:

Repr. 1B; Acute Tox. 4 *; Aquatic Chronic 2

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H302

Harmful if swallowed.

H411

Toxic to aquatic life with long lasting effects.

Classification according to CLP Regulation (EC) No 1272/2008. The complete list of hazard and precautionary statements can be found in the Safety Data Sheet (SDS).

First Aid Measures

Ingestion

Harmful

Measures if substance is accidentally swallowed

First Aid Actions

  • +P301IF SWALLOWED:
  • +P330Rinse mouth.
  • +P331Do NOT induce vomiting.
  • +P310Immediately call a POISON CENTER/doctor.

Related hazard statements:

General Measures

Emergency 112 | Poison Control: +49 30 19240 (DE), +33 1 45 42 59 59 (FR), +31 30 274 88 88 (NL)

First aid measures are based on CLP classification and associated P-statements. They do not replace the Safety Data Sheet (SDS). In case of emergency, always consult the full SDS and a physician.

Transport (ADR)

UN Number3077
ADR Class9
Packing GroupIII
Tunnel Code-
Proper Shipping Name2-Methyl-1-(4-methylthiophenyl)-2-morpholinopropan-1-on
Marine PollutantNo

Frequently Asked Questions

What is 2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one?

2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one is an organic compound with the molecular formula C15H21NO2S and CAS number 71868-10-5. This substance has a molecular weight of 279.4 g/mol and contains morpholine, phenyl, and methylsulfanyl functional groups. It is classified as a hazardous substance with reproductive toxicity, acute toxicity, and environmental hazard properties, requiring careful handling and specialized safety measures during use.

What are the physicochemical properties of 2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one?

2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one is a complex organic molecule with a molecular weight of 279.4 g/mol. The compound contains sulfur and nitrogen heteroatoms within its structure, featuring morpholine and methylsulfanyl groups attached to a phenyl ring. Its specific physical properties such as melting point, boiling point, and solubility characteristics would need to be determined through analytical testing or consultation of detailed technical data sheets.

What is 2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one used for?

2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one is typically used as a specialized chemical intermediate in pharmaceutical research and organic synthesis applications. Its morpholine-containing structure suggests potential use in medicinal chemistry development or as a building block for more complex pharmaceutical compounds. Given its hazardous classification, this substance is primarily intended for professional use in controlled laboratory or industrial environments by trained personnel with appropriate safety expertise.

How to safely handle 2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one?

2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one requires strict safety protocols due to its Repr. 1B and Acute Tox. 4 classifications. Personnel must wear appropriate PPE including chemical-resistant gloves, safety goggles, and respiratory protection. Work should be conducted in well-ventilated areas or under fume hoods. Avoid skin contact, inhalation, and ingestion. Pregnant women should not handle this substance due to its reproductive toxicity classification. Emergency washing facilities must be readily accessible.

How to properly store 2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one?

2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one should be stored in a cool, dry, well-ventilated area away from heat sources and incompatible materials. The container must be tightly sealed and properly labeled with hazard information. Storage areas should be restricted to authorized personnel only, with appropriate safety signage displayed. Given its environmental hazard classification, storage facilities must have adequate containment measures to prevent environmental release in case of spills or container failure.

What to do in case of contact with 2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one?

Immediate first aid for 2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one exposure includes: skin contact - remove contaminated clothing and wash thoroughly with soap and water; eye contact - flush immediately with clean water for at least 15 minutes; inhalation - move to fresh air immediately; ingestion - do not induce vomiting, rinse mouth with water. Seek immediate medical attention in all cases due to the substance's reproductive and acute toxicity. Provide the safety data sheet to medical personnel.

How to properly dispose of 2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one?

2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one must be disposed of through authorized hazardous waste management companies in accordance with local and EU regulations. The substance cannot be disposed of in regular waste streams due to its toxic and environmental hazard properties. Containers should be properly labeled and segregated from other waste types. Disposal methods typically include high-temperature incineration at licensed facilities. Consult local environmental authorities for specific disposal requirements in your region.

How to transport 2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one?

2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one is classified under ADR Class 9 (Miscellaneous Dangerous Substances), Packing Group III. Transportation requires proper packaging in UN-approved containers with appropriate hazard labels and documentation. Drivers must hold valid ADR certification for Class 9 materials. Transport vehicles should carry appropriate emergency equipment and spill containment materials. Shipping documentation must include the substance's UN number, proper shipping name, hazard class, and packing group information.

Is 2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one subject to specific regulations?

2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one is subject to various EU chemical regulations including CLP (Classification, Labelling and Packaging) due to its hazard classification. The substance requires safety data sheets, proper labeling with GHS pictograms (GHS07, GHS08, GHS09), and the danger signal word. It is not currently listed as a Substance of Very High Concern (SVHC). Users must comply with occupational exposure limits and environmental protection requirements under relevant national and EU legislation.

Where to buy 2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one in Europe?

2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one is available through OYSI, a specialized European distributor of technical chemicals. OYSI provides this substance with complete regulatory documentation, safety data sheets, and certificates of analysis. As a professional chemical distributor, OYSI ensures proper packaging, labeling, and transport arrangements compliant with European regulations. Contact OYSI directly for availability, technical specifications, and pricing information for this specialized chemical compound.

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2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one is a dangerous good. We support you with labeling, packaging, and transport documentation.

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Data Sources

Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.