4-hydroxy-3-[3-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]chromen-2-one

C31H24O3

CAS56073-07-5
GHS08 Gefahrensymbol: Gesundheitsgefahr – Gesundheitsgefahr
GHS06 Gefahrensymbol: Giftig – Totenkopf mit Knochen
GHS09 Gefahrensymbol: Umweltgefährlich – Umwelt
Danger

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Identification

CAS Number
56073-07-5
EC Number
259-978-4
UN Number
3027
Index Number
607-157-00-X
PubChem CID
54676884

Physical-chemical properties

Molecular Formula
C31H24O3
Molar Mass
444.50 g/mol
IUPAC Name
4-hydroxy-3-[3-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]chromen-2-one

Chemical Identifiers

InChI
InChI=1S/C31H24O3/c32-30-26-12-6-7-13-28(26)34-31(33)29(30)27-19-24(18-23-10-4-5-11-25(23)27)22-16-14-21(15-17-22)20-8-2-1-3-9-20/h1-17,24,27,32H,18-19H2
InChI Key
FVQITOLOYMWVFU-UHFFFAOYSA-N

Overview

4-hydroxy-3-[3-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]chromen-2-one (CAS 56073-07-5) is a complex organic compound with anticoagulant properties and significant toxicity concerns. This specialized chemical compound belongs to the chromen-2-one family and features a sophisticated molecular structure combining chromene, tetrahydronaphthalene, and biphenyl moieties. With a molecular formula of C31H24O3 and molecular weight of 444.5 g/mol, this substance represents an advanced synthetic organic molecule used primarily in pharmaceutical research and specialized industrial applications. The compound exhibits severe toxicity characteristics, classified under multiple hazard categories including Reproductive Toxicity 1B, Acute Toxicity 1, and Specific Target Organ Toxicity RE 1. These properties necessitate extreme caution during handling, storage, and transportation, requiring compliance with ADR Class 6.1 regulations for toxic substances. The presence of GHS pictograms 08, 06, and 09 indicates serious health hazards, acute toxicity, and environmental dangers respectively. Safety protocols demand specialized containment systems, personal protective equipment, and trained personnel for any handling procedures. The compound's aquatic toxicity classification requires particular attention to environmental protection measures during use and disposal. Industrial applications include pharmaceutical intermediate synthesis, specialized research projects, and development of anticoagulant formulations. Unlike simpler compounds such as N-methylaniline, this complex molecule requires sophisticated synthetic pathways and specialized handling procedures. Research applications often involve comparison studies with related anticoagulant compounds and structure-activity relationship investigations. OYSI maintains strict quality standards and regulatory compliance for this specialized chemical, ensuring proper documentation and safety protocols for qualified industrial customers requiring this advanced pharmaceutical intermediate.

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 Number3027
ADR Class6.1
Packing GroupI
Tunnel CodeC/E
Proper Shipping NameDifenacoum (ISO)
Marine PollutantNo

Frequently Asked Questions

What is 4-hydroxy-3-[3-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]chromen-2-one?

4-hydroxy-3-[3-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]chromen-2-one is a complex organic compound with the molecular formula C31H24O3 and CAS number 56073-07-5. This substance has a molecular weight of 444.5 g/mol and belongs to the chromen-2-one family of compounds. It is classified as an extremely hazardous substance with reproductive toxicity, acute toxicity, and environmental hazard properties requiring careful handling and specialized safety measures.

What are the physicochemical properties of 4-hydroxy-3-[3-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]chromen-2-one?

4-hydroxy-3-[3-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]chromen-2-one is an organic solid compound with a molecular weight of 444.5 g/mol and molecular formula C31H24O3. The substance contains multiple aromatic rings including phenyl, tetrahydronaphthalene, and chromen-2-one moieties. Specific physical properties such as melting point, color, odor, and solubility data are not available but should be determined based on laboratory analysis and supplier specifications.

What is 4-hydroxy-3-[3-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]chromen-2-one used for?

4-hydroxy-3-[3-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]chromen-2-one is primarily used in specialized research and pharmaceutical applications due to its complex aromatic structure. The compound may serve as an intermediate in organic synthesis or as a research chemical for studying chromen-2-one derivatives. Given its high toxicity classification, its use is restricted to professional laboratories and industrial facilities with appropriate safety infrastructure and qualified personnel.

How to handle 4-hydroxy-3-[3-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]chromen-2-one safely?

4-hydroxy-3-[3-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]chromen-2-one requires extreme safety precautions due to its Acute Tox. 1 and Repr. 1B classifications. Essential PPE includes chemical-resistant gloves, protective clothing, safety goggles, and respiratory protection. Work must be conducted in a well-ventilated area or fume hood. Avoid skin contact, inhalation, and ingestion. Only trained personnel should handle this substance following strict safety protocols and emergency procedures.

How to store 4-hydroxy-3-[3-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]chromen-2-one correctly?

4-hydroxy-3-[3-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]chromen-2-one must be stored in a secure, well-ventilated area away from heat, ignition sources, and incompatible materials. Use original containers with proper labeling including GHS pictograms (GHS06, GHS08, GHS09). Storage areas should be restricted to authorized personnel only due to the substance's high toxicity. Implement appropriate containment measures to prevent environmental release and maintain inventory records as required by regulations.

What to do in case of contact with 4-hydroxy-3-[3-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]chromen-2-one?

Immediate emergency response is critical for contact with 4-hydroxy-3-[3-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]chromen-2-one due to its Acute Tox. 1 classification. For skin contact, remove contaminated clothing and rinse thoroughly with water. For eye contact, flush immediately with clean water for at least 15 minutes. If inhaled, move to fresh air. For ingestion, do not induce vomiting. Seek immediate medical attention in all cases and provide the safety data sheet to medical personnel.

How to dispose of 4-hydroxy-3-[3-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]chromen-2-one appropriately?

4-hydroxy-3-[3-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]chromen-2-one must be disposed of as hazardous waste through licensed waste management companies due to its high toxicity and environmental hazard classifications. The substance cannot be disposed of in regular waste streams or sewage systems. Collection, transport, and disposal must comply with local, national, and EU waste regulations. Contaminated containers and materials also require specialized hazardous waste disposal procedures.

How to transport 4-hydroxy-3-[3-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]chromen-2-one?

4-hydroxy-3-[3-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]chromen-2-one is classified under ADR Class 6.1 (Toxic substances), Packing Group I, indicating maximum danger level. Transport requires UN-specification packaging, proper dangerous goods documentation, vehicle placarding, and qualified drivers with ADR certification. Emergency response information must accompany shipments. Only authorized carriers experienced in handling Class 6.1 substances should transport this material following strict dangerous goods regulations.

Is 4-hydroxy-3-[3-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]chromen-2-one subject to special regulations?

4-hydroxy-3-[3-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]chromen-2-one is subject to strict regulations under EU CLP Regulation due to its multiple hazard classifications including reproductive toxicity (Repr. 1B) and acute toxicity (Acute Tox. 1). While not currently listed as SVHC under REACH, its use may be restricted in consumer products. Companies must maintain safety data sheets, implement risk management measures, and ensure proper classification, labeling, and packaging compliance.

Where to buy 4-hydroxy-3-[3-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]chromen-2-one in Europe?

4-hydroxy-3-[3-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]chromen-2-one is available through OYSI, a specialized European distributor of technical chemicals. Given the substance's extreme hazard classification, procurement is restricted to qualified industrial users and research institutions with appropriate safety infrastructure. OYSI ensures proper regulatory compliance, documentation, and safe delivery throughout Europe. Contact OYSI directly to discuss specific requirements, quantities, and technical specifications for your application needs.

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4-hydroxy-3-[3-(4-phenylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]chromen-2-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.