2-[2-(4-chlorophenyl)-2-phenylacetyl]indene-1,3-dione

C23H15ClO3

CAS3691-35-8
GHS08 Gefahrensymbol: Gesundheitsgefahr – Gesundheitsgefahr
GHS06 Gefahrensymbol: Giftig – Totenkopf mit Knochen
GHS09 Gefahrensymbol: Umweltgefährlich – Umwelt
Danger

Consulting for 2-[2-(4-chlorophenyl)-2-phenylacetyl]indene-1,3-dione

Our experts support you with application, dosage, and compliance.

Request Consultation

Identification

CAS Number
3691-35-8
EC Number
223-003-0
UN Number
2761
Index Number
606-014-00-9
PubChem CID
19402

Physical-chemical properties

Molecular Formula
C23H15ClO3
Molar Mass
374.80 g/mol
IUPAC Name
2-[2-(4-chlorophenyl)-2-phenylacetyl]indene-1,3-dione

Chemical Identifiers

InChI
InChI=1S/C23H15ClO3/c24-16-12-10-15(11-13-16)19(14-6-2-1-3-7-14)23(27)20-21(25)17-8-4-5-9-18(17)22(20)26/h1-13,19-20H
InChI Key
UDHXJZHVNHGCEC-UHFFFAOYSA-N

Overview

2-[2-(4-chlorophenyl)-2-phenylacetyl]indene-1,3-dione (CAS 3691-35-8) is an organic compound featuring an indanedione core structure with chlorophenyl and phenylacetyl substituents. This complex organic molecule with the molecular formula C23H15ClO3 and molecular weight of 374.8 g/mol represents a specialized chemical intermediate characterized by its unique structural arrangement combining an indene-1,3-dione backbone with aromatic substituents. The presence of the 4-chlorophenyl group and phenylacetyl moiety imparts distinct chemical properties that make this compound valuable for specific industrial applications. The substance exhibits significant safety considerations, classified under multiple hazard categories including reproductive toxicity (Repr. 1B), acute toxicity (Acute Tox. 1), and specific target organ toxicity with repeated exposure (STOT RE 1). Additionally, it poses environmental concerns with aquatic toxicity classifications (Aquatic Acute 1, Aquatic Chronic 1). The compound requires careful handling protocols consistent with ADR Class 6.1 toxic substances and displays the corresponding GHS pictograms (GHS06, GHS08, GHS09) with the signal word "Danger." From a structural chemistry perspective, this indanedione derivative shares certain characteristics with related aromatic compounds, though it differs significantly from simpler aromatic amines like N-methylaniline in terms of complexity and application scope. The compound's multi-ring system and specific substitution pattern distinguish it within the broader family of indanedione-based chemicals. Primary industrial applications include use as a chemical intermediate in pharmaceutical synthesis, specialty organic chemistry research, and potentially as a precursor in the development of advanced materials. The compound may also find application in analytical chemistry as a reagent for specific detection or derivatization procedures. OYSI provides this specialized chemical compound to meet the demanding requirements of European industrial and research customers, ensuring consistent quality and regulatory compliance.

Safety & Classification

Danger
Classification:

Repr. 1B; Acute Tox. 1; Acute Tox. 1; Acute Tox. 1; STOT RE 1; Aquatic Acute 1; Aquatic Chronic 1

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H330

Fatal if inhaled.

H310

Fatal in contact with skin.

H300

Fatal if swallowed.

H372

Causes damage to organs through prolonged or repeated exposure.

H400

Very toxic to aquatic life.

H410

Very 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

Inhalation

Fatal

Measures if vapours or dust are inhaled

First Aid Actions

  • +P304IF INHALED:
  • +P340Remove person to fresh air and keep comfortable for breathing.
  • +P311Call a POISON CENTER/doctor.

Related hazard statements:

Skin Contact

Fatal

Measures if substance contacts the skin

First Aid Actions

  • +P302IF ON SKIN:
  • +P352Wash with plenty of water.
  • +P361Take off immediately all contaminated clothing.
  • +P313Get medical advice/attention.

Related hazard statements:

Ingestion

Fatal

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 Number2761
ADR Class6.1
Packing GroupI
Tunnel CodeC/E
Proper Shipping NameChlorphacinon (ISO)
Marine PollutantNo

Frequently Asked Questions

What is 2-[2-(4-chlorophenyl)-2-phenylacetyl]indene-1,3-dione?

2-[2-(4-chlorophenyl)-2-phenylacetyl]indene-1,3-dione is an organic chemical compound with the molecular formula C23H15ClO3 and CAS number 3691-35-8. This substance has a molecular weight of 374.8 g/mol and features a complex structure containing chlorophenyl, phenyl, and indene-dione groups. It is classified as an extremely hazardous chemical with multiple toxicity concerns including reproductive toxicity, acute toxicity, and environmental hazards, requiring careful handling and specialized safety measures.

What are the physicochemical properties of 2-[2-(4-chlorophenyl)-2-phenylacetyl]indene-1,3-dione?

2-[2-(4-chlorophenyl)-2-phenylacetyl]indene-1,3-dione is a solid organic compound at room temperature with a molecular weight of 374.8 g/mol. The substance contains chlorine, carbon, hydrogen, and oxygen atoms in its molecular structure (C23H15ClO3). As an indene-dione derivative with aromatic substituents, it likely exhibits limited water solubility but may be soluble in organic solvents. Specific physical properties such as melting point, boiling point, and exact appearance should be confirmed through technical data sheets.

What is 2-[2-(4-chlorophenyl)-2-phenylacetyl]indene-1,3-dione used for?

2-[2-(4-chlorophenyl)-2-phenylacetyl]indene-1,3-dione is primarily used as an intermediate in pharmaceutical synthesis and chemical research applications. Its complex aromatic structure makes it valuable for developing pharmaceutical compounds and specialty chemicals. Due to its high toxicity classification (Acute Tox. 1, Repr. 1B), its use is restricted to specialized industrial processes and research facilities with appropriate safety infrastructure. The substance requires professional handling and is typically employed in controlled manufacturing environments for the production of more complex chemical entities.

How to safely handle 2-[2-(4-chlorophenyl)-2-phenylacetyl]indene-1,3-dione?

2-[2-(4-chlorophenyl)-2-phenylacetyl]indene-1,3-dione requires maximum safety precautions due to its Acute Tox. 1 and Repr. 1B classifications. Essential PPE includes full-face respiratory protection, chemical-resistant gloves, protective clothing, and safety goggles. Work must be conducted in well-ventilated areas or fume hoods to prevent inhalation exposure. Avoid skin contact, ingestion, and inhalation. Emergency procedures and safety equipment should be readily available. Only trained personnel should handle this substance following strict safety protocols and workplace exposure limits.

How to properly store 2-[2-(4-chlorophenyl)-2-phenylacetyl]indene-1,3-dione?

2-[2-(4-chlorophenyl)-2-phenylacetyl]indene-1,3-dione must be stored in a cool, dry, well-ventilated area away from heat sources and incompatible materials. Use tightly sealed, labeled containers made of compatible materials to prevent contamination and exposure. Storage areas should be secured with restricted access due to the substance's high toxicity. Implement appropriate spill containment measures and maintain emergency response equipment nearby. Regular inventory checks and proper segregation from other chemicals are essential to ensure safe storage conditions and regulatory compliance.

What to do in case of contact with 2-[2-(4-chlorophenyl)-2-phenylacetyl]indene-1,3-dione?

Immediate medical attention is required for any exposure to 2-[2-(4-chlorophenyl)-2-phenylacetyl]indene-1,3-dione due to its Acute Tox. 1 classification. For skin contact, immediately remove contaminated clothing and wash thoroughly with soap and water. In case of eye contact, flush with clean water for at least 15 minutes. If inhaled, move to fresh air immediately. For ingestion, do not induce vomiting and seek emergency medical care. Contact poison control centers and provide the safety data sheet to medical personnel for proper treatment guidance.

How to properly dispose of 2-[2-(4-chlorophenyl)-2-phenylacetyl]indene-1,3-dione?

2-[2-(4-chlorophenyl)-2-phenylacetyl]indene-1,3-dione must be disposed of as hazardous waste through licensed waste management companies specializing in toxic chemical disposal. Due to its multiple hazard classifications including acute toxicity and environmental hazards, incineration at high temperatures in authorized facilities is typically required. Never dispose of this substance in regular waste streams, sewers, or the environment. Consult local environmental regulations and waste disposal authorities for specific requirements. Maintain proper documentation throughout the disposal process to ensure regulatory compliance.

How to transport 2-[2-(4-chlorophenyl)-2-phenylacetyl]indene-1,3-dione?

2-[2-(4-chlorophenyl)-2-phenylacetyl]indene-1,3-dione is classified as ADR Class 6.1 (toxic substances) Packing Group I, indicating maximum danger level for transport. Transportation requires UN-approved packaging, proper hazardous goods documentation, and trained personnel. Vehicles must display appropriate placards and emergency information. Shipments must comply with international dangerous goods regulations (ADR/RID for road/rail, IMDG for sea, IATA for air). Only authorized carriers experienced in handling highly toxic chemicals should transport this substance, ensuring emergency response capabilities are available.

Is 2-[2-(4-chlorophenyl)-2-phenylacetyl]indene-1,3-dione subject to specific regulations?

2-[2-(4-chlorophenyl)-2-phenylacetyl]indene-1,3-dione is subject to extensive chemical safety regulations under REACH and CLP frameworks in Europe. Its multiple hazard classifications (Repr. 1B, Acute Tox. 1, STOT RE 1) trigger strict handling requirements, exposure limits, and safety documentation obligations. While not currently listed as an SVHC, its toxicity profile may subject it to authorization procedures or restrictions. Companies must maintain comprehensive safety data sheets, conduct risk assessments, and implement appropriate risk management measures throughout the supply chain.

Where to buy 2-[2-(4-chlorophenyl)-2-phenylacetyl]indene-1,3-dione in Europe?

2-[2-(4-chlorophenyl)-2-phenylacetyl]indene-1,3-dione is available through OYSI, a specialized European distributor of technical chemicals and pharmaceutical intermediates. As a highly toxic substance requiring professional handling, it is only supplied to qualified industrial users and research institutions with appropriate safety infrastructure. OYSI ensures compliance with all regulatory requirements including proper documentation, packaging, and transportation. Contact OYSI directly to discuss availability, technical specifications, and regulatory compliance requirements for your specific application needs.

Data Sources

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