3-[3-[4-(4-bromophenyl)phenyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-4-hydroxychromen-2-one
C31H23BrO3
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Identification
- CAS Number
- 56073-10-0
- EC Number
- 259-980-5
- UN Number
- 3027
- Index Number
- 607-172-00-1
- PubChem CID
- 54680676
Physical-chemical properties
- Molecular Formula
- C31H23BrO3
- Molar Mass
- 523.40 g/mol
- IUPAC Name
- 3-[3-[4-(4-bromophenyl)phenyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-4-hydroxychromen-2-one
Chemical Identifiers
- InChI
- InChI=1S/C31H23BrO3/c32-24-15-13-20(14-16-24)19-9-11-21(12-10-19)23-17-22-5-1-2-6-25(22)27(18-23)29-30(33)26-7-3-4-8-28(26)35-31(29)34/h1-16,23,27,33H,17-18H2
- InChI Key
- VEUZZDOCACZPRY-UHFFFAOYSA-N
Overview
3-[3-[4-(4-bromophenyl)phenyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-4-hydroxychromen-2-one (CAS 56073-10-0) is a complex brominated organic compound with tetrahydronaphthalene and chromenone structural components. This sophisticated chemical compound belongs to the class of brominated aromatic compounds featuring multiple ring systems including tetrahydronaphthalene and chromen-2-one moieties. With its molecular formula C31H23BrO3 and molecular weight of 523.4 g/mol, this substance represents a highly complex organic structure containing bromine substitution on a phenyl ring system. The compound is classified under EC number 259-980-5 and carries significant safety considerations due to its classification as Repr. 1A, Acute Tox. 1, and STOT RE 1, requiring careful handling protocols. The substance exhibits severe toxicity profiles across multiple exposure routes and is classified as hazardous to aquatic environments with both acute and chronic toxicity classifications. Its ADR classification of 6.1 indicates it falls under toxic substances for transportation purposes, necessitating specialized shipping and storage requirements. Unlike simpler aromatic compounds such as N-methylaniline, this multi-ring brominated structure presents more complex handling challenges due to its size and halogenated nature. Primary industrial applications include specialized pharmaceutical intermediates, advanced materials synthesis, and research applications in organic chemistry where its unique structural features provide specific reactivity patterns. The compound serves as a building block in complex organic synthesis processes and finds use in specialized chemical manufacturing where its brominated aromatic system offers distinct chemical properties. The compound's complex structure and multiple ring systems make it valuable for applications requiring specific molecular architecture and controlled reactivity profiles. OYSI maintains availability of this specialized chemical compound for qualified industrial and research customers requiring high-purity brominated organic intermediates.
Safety & Classification
Repr. 1A; Acute Tox. 1; Acute Tox. 1; Acute Tox. 1; STOT RE 1; Aquatic Acute 1; Aquatic Chronic 1
GHS Pictograms
HHazard Statements (H-Statements)
Describe the nature and severity of the hazard
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
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
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
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 Number | 3027 |
| ADR Class | 6.1 |
| Packing Group | I |
| Tunnel Code | C/E |
| Proper Shipping Name | Brodifacoum (ISO) |
| Marine Pollutant | No |
Frequently Asked Questions
What is 3-[3-[4-(4-bromophenyl)phenyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-4-hydroxychromen-2-one?
3-[3-[4-(4-bromophenyl)phenyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-4-hydroxychromen-2-one is a complex organic compound with the molecular formula C31H23BrO3 and CAS number 56073-10-0. This brominated aromatic compound has a molecular weight of 523.4 g/mol and features a chromen-2-one core structure linked to a tetrahydronaphthalene moiety and a bromophenyl group. It is classified as an extremely hazardous substance with multiple toxicity concerns including reproductive toxicity and acute toxicity.
What are the physicochemical properties of 3-[3-[4-(4-bromophenyl)phenyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-4-hydroxychromen-2-one?
This compound is a solid organic material with a molecular weight of 523.4 g/mol and molecular formula C31H23BrO3. The presence of multiple aromatic rings and a bromine atom suggests limited water solubility but good solubility in organic solvents. The hydroxyl group on the chromen-2-one structure may contribute to some polar interactions. Specific physical properties such as melting point, boiling point, and exact solubility data should be confirmed through analytical testing or supplier documentation.
What is 3-[3-[4-(4-bromophenyl)phenyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-4-hydroxychromen-2-one used for?
This compound is typically used in specialized research and pharmaceutical applications due to its complex aromatic structure. Its specific applications may include use as a research chemical, intermediate in organic synthesis, or in pharmaceutical development. Given its high toxicity profile (Repr. 1A, Acute Tox. 1), it requires specialized handling and is limited to professional use in controlled laboratory environments. Industrial applications would be restricted to facilities with appropriate safety infrastructure and qualified personnel.
How to handle 3-[3-[4-(4-bromophenyl)phenyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-4-hydroxychromen-2-one safely?
This substance requires extreme caution due to its Acute Tox. 1 and Repr. 1A classification. Personnel must wear full personal protective equipment including chemical-resistant gloves, safety goggles, protective clothing, and respiratory protection in well-ventilated areas or fume hoods. Work should only be conducted by trained professionals in controlled laboratory environments. Avoid all contact with skin, eyes, and inhalation. Emergency procedures and first aid measures must be readily available before handling.
How to store 3-[3-[4-(4-bromophenyl)phenyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-4-hydroxychromen-2-one correctly?
This compound must be stored in a secure, well-ventilated area away from heat, ignition sources, and incompatible materials. Use tightly sealed, chemically resistant containers in a cool, dry location with restricted access due to its high toxicity classification. Storage areas should have appropriate containment measures and emergency equipment. Keep away from oxidizing agents and other reactive substances. Regular inventory checks and proper labeling according to GHS requirements (GHS06, GHS08, GHS09 pictograms) are essential.
What to do in case of contact with 3-[3-[4-(4-bromophenyl)phenyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-4-hydroxychromen-2-one?
Immediate medical attention is required for any exposure due to the Acute Tox. 1 classification. For skin contact, remove contaminated clothing and rinse thoroughly with water for at least 15 minutes. In case of eye contact, flush with clean water for 15 minutes and remove contact lenses if present. If inhaled, move to fresh air immediately. For ingestion, do not induce vomiting and seek immediate medical care. Contact poison control centers and provide the safety data sheet to medical personnel.
How to dispose of 3-[3-[4-(4-bromophenyl)phenyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-4-hydroxychromen-2-one appropriately?
This substance requires disposal as hazardous waste through licensed waste management companies due to its high toxicity and environmental hazard classification (Aquatic Acute 1, Aquatic Chronic 1). Disposal must comply with local, national, and EU waste regulations including the Waste Framework Directive. Incineration at high temperatures in specialized facilities is typically required. Container disposal must follow the same hazardous waste protocols. Never dispose of through regular waste streams or discharge to sewers or environment.
How to transport 3-[3-[4-(4-bromophenyl)phenyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-4-hydroxychromen-2-one?
This substance is classified under ADR Class 6.1 (Toxic substances), Packing Group I, indicating the highest level of toxicity for transport purposes. Specialized packaging, labeling, and documentation are required according to ADR regulations. Only qualified carriers with appropriate permits and training can transport this material. Vehicles must carry emergency equipment and proper placarding. Transport documents must include proper shipping names, hazard classes, and emergency contact information for incidents during transport.
Is 3-[3-[4-(4-bromophenyl)phenyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-4-hydroxychromen-2-one subject to specific regulations?
This substance is subject to comprehensive EU chemical regulations including REACH registration requirements and CLP classification and labeling. While not currently listed as an SVHC, its Repr. 1A classification means it may be subject to authorization procedures under REACH Annex XIV in the future. The compound must comply with workplace exposure limits, environmental discharge restrictions, and may require notification for certain uses. Users must maintain safety data sheets and ensure proper worker training and exposure monitoring.
Where to buy 3-[3-[4-(4-bromophenyl)phenyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-4-hydroxychromen-2-one in Europe?
OYSI serves as a specialized European distributor for this high-hazard chemical compound, providing professional-grade materials to qualified customers. Due to its extreme toxicity classification, purchase is restricted to authorized users with appropriate safety infrastructure and regulatory compliance. Customers must demonstrate proper storage, handling capabilities, and legitimate use applications. OYSI ensures full regulatory compliance including proper documentation, safety data sheets, and transport arrangements according to ADR Class 6.1 requirements for European delivery.
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3-[3-[4-(4-bromophenyl)phenyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-4-hydroxychromen-2-one is a dangerous good. We support you with labeling, packaging, and transport documentation.
Data Sources
Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.