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Ethyl 4-(8-chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)-1-piperidinecarboxylate(CAS: 79794-75-5)

Ethyl 4-(8-chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)-1-piperidinecarboxylate
CAS Number

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Basic Information

Molecular Formula
C22H23ClN2O2
Molecular Weight
382.89 g/mol
Physical State
Powder

Physical Properties

Melting Point
135.0 to 139.0 deg-C
Boiling Point
531.3°C at 760 mmHg
Density
1.261
Flash Point
275.1±30.1 °C
Water Solubility
It is soluble in DMSO (50 mg/ml), ethanol (77 mg/ml at 25°C), water (<1 mg/ml at 25°C), chloroform, and methanol.

Chemical Identifiers

SMILES
CCOC(=O)N1CCC(=C2c3ccc(Cl)cc3CCc4cccnc24)CC1
InChIKey
JCCNYMKQOSZNPW-UHFFFAOYSA-N

Database References

MDL Number
MFCD00672869

FAQ

Ethyl 4-(8-chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)-1-piperidinecarboxylate (CAS: 79794-75-5) is a complex organic compound with a molecular formula of C22H26ClNO3. It features a piperidinecarboxylate group linked to a benzo[cyclohepta]pyridine ring bearing an 8-chloro substitution. This compound is notable for its structural complexity and potential applications in pharmaceutical research. Its physical properties include solubility in organic solvents and stability under controlled conditions.
Ethyl 4-(8-chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)-1-piperidinecarboxylate (CAS: 79794-75-5) is primarily used in pharmaceutical research as a potential drug candidate or synthetic intermediate. Its unique structure may contribute to biological activity, making it relevant for developing treatments targeting neurological or metabolic disorders. It also serves in medicinal chemistry for compound modification and in structural studies of complex molecules.
Safety data for Ethyl 4-(8-chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)-1-piperidinecarboxylate (CAS: 79794-75-5) is limited. However, as a chlorinated organic compound, it may pose mild toxicity risks. Handle with gloves, goggles, and in a well-ventilated area. Avoid skin and eye contact. Adhere to standard chemical safety protocols and consult safety data sheets for precise guidelines. Always follow OSHA and EPA regulations for safe usage.
Store Ethyl 4-(8-chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)-1-piperidinecarboxylate (CAS: 79794-75-5) in a cool, dry, and dark place, ideally below 25°C. Keep it in a sealed, airtight container to prevent moisture ingress and degradation. Avoid exposure to heat or direct light. Ensure proper labeling and store away from incompatible substances. Maintain stability by following recommended storage conditions for chemical safety and longevity.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

Always follow proper handling procedures