(1S,2R,8S)-14-Oxa-7-azatetracyclo[6.6.1.0~1,11~.0~2,7~]pentadeca-9,11-dien-13-one

Basic Information

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CAS Number

5610-40-2

Molecular Formula

C13H15NO2

Molecular Weight

217.27 g/mol

Basic Physical Properties

Physical State

Yellow powder

Melting Point

146 ºC

Boiling Point

357.82°C (rough estimate)

Flash Point

197 ºC

Refractive Index

1.5300 (estimate)

Specific Rotation

D20 -1042° (c = 1 in alc)

SMILES

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O=C1O[C@]2(C[C@H]3C=CC2=C1)[C@H]4CCCCN34

InChI

InChI=1S/C13H15NO2/c15-12-7-9-4-5-10-8-13(9,16-12)11-3-1-2-6-14(10)11/h4-5,7,10-11H,1-3,6,8H2/t10-,11-,13+/m1/s1

InChIKey

SWZMSZQQJRKFBP-WZRBSPASSA-N

LogP

1.405

Topological Polar Surface Area

29.54 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

426

Safety Information

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GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Storage Conditions

2-8℃

Synonyms & References

English

securinine
SECURAN-11-ONE
(-)-securinin
securinan-11-one
securinin
Securinan-11-on
SECURININE(RG)
(2β,7S,9S)-Securinan-11-one
8H-6,11b-Methanofuro[2,3-c]pyrido[1,2-a]azepin-2(6H)-one,9,10,11,11a-tetrahydro-, (6S,11aR,11b...
8H-6,11b-Methanofuro[2,3-c]pyrido[1,2-a]azepin-2(6H)-one,9,10,11,11a-tetrahydro-, (6S,11aR,11bS)-
1,2,3,4,10,10a-Hexahydro-10-hydroxy
Securan one
TNP00256
NE56622
(1S,2R,8R)-14-Oxa-7-azatetracyclo[6.6.1.0^{1,11}.0^{2,7}]pentadeca-9,11-dien-13-one
(-)-Securinine
Securinine, (-)-
G4VS580P5E
Virosecurinine
Viroallosecurinine
Securinina
Securininum
Securinine [INN]
Securininum [INN-Latin]
Se

MDL Number

MFCD00867422

FAQ

What is (1S,2R,8S)-14-Oxa-7-azatetracyclo[6.6.1.0~1,11~.0~2,7~]pentadeca-9,11-dien-13-one (CAS: 5610-40-2)?

(1S,2R,8S)-14-Oxa-7-azatetracyclo[6.6.1.0~1,11~.0~2,7~]pentadeca-9,11-dien-13-one is an organic compound with the CAS number 5610-40-2. It has a complex molecular structure consisting of a seven-membered and a five-membered ring system, with a double bond and a ketone group. It is typically used in pharmaceuticals and research for its specific chemical properties.

What are the main uses of (1S,2R,8S)-14-Oxa-7-azatetracyclo[6.6.1.0~1,11~.0~2,7~]pentadeca-9,11-dien-13-one (CAS: 5610-40-2)?

(1S,2R,8S)-14-Oxa-7-azatetracyclo[6.6.1.0~1,11~.0~2,7~]pentadeca-9,11-dien-13-one is primarily used in pharmaceutical research and development, particularly in the synthesis of complex drugs and as a precursor for other organic compounds. It is also used in advanced chemical synthesis and academic research.

Is (1S,2R,8S)-14-Oxa-7-azatetracyclo[6.6.1.0~1,11~.0~2,7~]pentadeca-9,11-dien-13-one (CAS: 5610-40-2) safe?

The safety of (1S,2R,8S)-14-Oxa-7-azatetracyclo[6.6.1.0~1,11~.0~2,7~]pentadeca-9,11-dien-13-one (CAS: 5610-40-2) depends on its intended use and handling conditions. It is important to follow all safety guidelines and use appropriate personal protective equipment (PPE) when handling this compound. It should be stored in a cool, dry place away from direct sunlight and other sources of heat.

How should (1S,2R,8S)-14-Oxa-7-azatetracyclo[6.6.1.0~1,11~.0~2,7~]pentadeca-9,11-dien-13-one (CAS: 5610-40-2) be stored?

(1S,2R,8S)-14-Oxa-7-azatetracyclo[6.6.1.0~1,11~.0~2,7~]pentadeca-9,11-dien-13-one (CAS: 5610-40-2) should be stored in a cool, dry place to prevent degradation. It should be kept away from direct sunlight and sources of heat. The container should be airtight and labeled with the correct CAS number and safety information. It is best to store it in a laboratory setting with proper ventilation and safety measures in place.