(2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene
C11H11FO2
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Identification
- CAS Number
- 793669-26-8
- EC Number
- 419-630-6
- UN Number
- 3082
- Index Number
- 613-228-00-6
- PubChem CID
- 51698391
Physical-chemical properties
- Molecular Formula
- C11H11FO2
- Molar Mass
- 194.20 g/mol
- IUPAC Name
- (2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene
Chemical Identifiers
- InChI
- InChI=1S/C11H11FO2/c12-8-2-4-9-7(5-8)1-3-10(14-9)11-6-13-11/h2,4-5,10-11H,1,3,6H2/t10-,11+/m0/s1
- InChI Key
- GVZDIJGBXSDSEP-WDEREUQCSA-N
Overview
(2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene (CAS 793669-26-8) is a fluorinated chromene derivative with epoxide functionality and chiral stereochemistry. This specialized organic compound represents a unique combination of structural features, incorporating both a dihydrochromene backbone and an epoxide ring system. The presence of fluorine substitution at the 6-position enhances its chemical properties, while the defined stereochemistry at both the chromene and epoxide centers provides specific molecular recognition capabilities. With a molecular formula of C11H11FO2 and molecular weight of 194.2 g/mol, this compound exhibits moderate molecular complexity suitable for various synthetic applications. From a safety perspective, the substance is classified as Aquatic Chronic 2 under GHS regulations, requiring appropriate environmental handling measures as indicated by the GHS09 pictogram. Its ADR Class 9 designation categorizes it as a miscellaneous dangerous substance for transportation purposes, though it carries no specific signal word for workplace handling. The dual functionality of the epoxide ring and fluorinated chromene structure makes this compound particularly valuable in pharmaceutical intermediate synthesis and specialty chemical manufacturing. Its chiral nature enables stereoselective synthetic transformations, while the reactive epoxide group provides versatile coupling opportunities. Industrial applications commonly include use as a building block in medicinal chemistry programs and as an intermediate in the production of bioactive compounds. Unlike structurally distinct compounds such as 4-[9-(4-amino-3-chlorophenyl)fluoren-9-yl]-2-chloroaniline, this chromene derivative offers unique reactivity patterns suited for specific synthetic methodologies. OYSI maintains reliable supply chains for this specialized fluorinated chromene derivative, supporting European customers' technical and research requirements.
Safety & Classification
Aquatic Chronic 2
GHS Pictograms
HHazard Statements (H-Statements)
Describe the nature and severity of the hazard
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
Transport (ADR)
| UN Number | 3082 |
| ADR Class | 9 |
| Packing Group | III |
| Tunnel Code | - |
| Proper Shipping Name | (+/-)-(R*,S*)-6-Fluor-3,4-dihydro-2-oxiranyl-2H-1-benzopyran |
| Marine Pollutant | No |
Frequently Asked Questions
What is (2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene?
(2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene is an organic compound with the molecular formula C11H11FO2 and CAS number 793669-26-8. This chiral molecule features a chromene backbone with a fluorine substituent and an epoxide group, giving it a molecular weight of 194.2 g/mol. The compound contains two stereocenters, indicated by the (2S) and (2R) stereochemical descriptors, making it an optically active substance with specific three-dimensional arrangement.
What are the physicochemical properties of (2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene?
(2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene is a solid organic compound at room temperature with a molecular weight of 194.2 g/mol. The presence of the fluorine atom and epoxide ring influences its chemical reactivity and physical properties. The chromene structure provides aromatic stability while the epoxide group makes it susceptible to ring-opening reactions. Specific data regarding melting point, boiling point, and solubility characteristics would require detailed analytical testing.
What is (2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene used for?
(2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene is primarily used as an intermediate in pharmaceutical synthesis and fine chemical manufacturing. The compound's unique structural features, including the fluorinated chromene core and reactive epoxide group, make it valuable for developing bioactive molecules. Its chiral nature makes it particularly useful in stereoselective synthesis processes where specific optical activity is required for the final pharmaceutical or agrochemical products.
How to handle (2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene safely?
(2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene should be handled with standard laboratory safety precautions including wearing appropriate personal protective equipment. Use chemical-resistant gloves, safety goggles, and work in a well-ventilated area or fume hood. Avoid direct skin contact and inhalation. The compound does not carry specific hazard pictograms for human health, but the presence of the reactive epoxide group suggests potential for causing irritation. Always follow good laboratory practices and handle with care.
How to store (2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene correctly?
(2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene should be stored in a cool, dry place away from direct sunlight and heat sources. Keep containers tightly closed to prevent contamination and moisture absorption. Due to the reactive epoxide group, avoid storage near strong acids or bases that could catalyze ring-opening reactions. Store in appropriate chemical storage areas with adequate ventilation. The compound is classified as Aquatic Chronic 2, so prevent environmental release during storage.
What to do in case of contact with (2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene?
In case of skin contact with (2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene, immediately wash the affected area with plenty of water for at least 15 minutes. Remove contaminated clothing. For eye contact, rinse thoroughly with water for several minutes and seek medical attention if irritation persists. If inhaled, move to fresh air immediately. In case of accidental ingestion, do not induce vomiting and seek immediate medical attention. Always consult the safety data sheet for detailed emergency procedures.
How to dispose of (2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene appropriately?
(2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene must be disposed of as hazardous chemical waste through licensed waste disposal companies. Due to its Aquatic Chronic 2 classification, it poses environmental risks and cannot be disposed of through regular waste streams or released into waterways. Contact authorized chemical waste disposal services that can handle organic compounds. Follow local and national regulations for hazardous waste disposal, including proper labeling and documentation of waste containers.
How to transport (2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene?
(2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene is classified as ADR Class 9 (Miscellaneous dangerous substances), Packing Group III for transportation purposes. This classification indicates it poses a relatively lower transport risk compared to more hazardous materials. Use appropriate packaging that meets UN specification requirements for Class 9 substances. Ensure proper labeling with the correct shipping name, UN number, and hazard class. Transport should be handled by qualified carriers familiar with chemical transport regulations.
Is (2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene subject to specific regulations?
(2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene is subject to REACH regulation in Europe and CLP classification requirements. The compound is classified under CLP as Aquatic Chronic 2 with GHS09 environmental pictogram, requiring appropriate labeling and safety data sheets. It is not currently listed as a Substance of Very High Concern (SVHC). Companies handling this substance must comply with registration, evaluation, and authorization requirements under REACH, including downstream user obligations and communication throughout the supply chain.
Where to buy (2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene in Europe?
(2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene is available through OYSI, a specialized European distributor of fine chemicals and pharmaceutical intermediates. OYSI provides reliable supply of research chemicals and industrial intermediates across Europe, ensuring compliance with REACH and CLP regulations. As a professional chemical supplier, OYSI offers proper documentation including certificates of analysis and safety data sheets. Contact OYSI directly to inquire about availability, specifications, and delivery options for this specialized chromene derivative.
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(2S)-6-fluoro-2-[(2R)-oxiran-2-yl]-3,4-dihydro-2H-chromene 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.