Bicyclo[4.2.0]octa-1,3,5-trien-7-yl(methyl) ketone O-allyl oxime is a complex organic compound with the molecular formula C12H13NO. It is a derivative of bicyclo[4.2.0]octa-1,3,5-trien-7-yl methyl ketone, featuring an oxime group attached to the carbonyl carbon. Bicyclo[4.2.0]octa-1,3,5-trien-7-yl(methyl) ketone O-allyl oxime is characterized by its bicyclic structure, with a seven-membered ring and a five-membered ring fused together. The presence of the oxime group, which is formed by the reaction of a carbonyl group with hydroxylamine, imparts unique chemical properties to the molecule. Bicyclo[4.2.0]octa-1,3,5-trien-7-yl(methyl) ketone O-allyl oxime is of interest in organic chemistry due to its potential applications in the synthesis of various pharmaceuticals and other organic compounds. Its structure and reactivity make it a valuable intermediate in the preparation of complex organic molecules.
6813-95-2
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Basic information
- Product Name: Bicyclo[4.2.0]octa-1,3,5-trien-7-yl(methyl) ketone O-allyl oxime
- Synonyms: Bicyclo[4.2.0]octa-1,3,5-trien-7-yl(methyl) ketone O-allyl oxime
- CAS NO:6813-95-2
- Molecular Formula: C13H15NO
- Molecular Weight: 201.29
- EINECS: N/A
- Product Categories: N/A
- Mol File: 6813-95-2.mol
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Chemical Properties
- Melting Point: N/A
- Boiling Point: 339.19°C (rough estimate)
- Flash Point: 110.321°C
- Appearance: /
- Density: 1.0405 (rough estimate)
- Vapor Pressure: 0.002mmHg at 25°C
- Refractive Index: 1.5300 (estimate)
- Storage Temp.: N/A
- Solubility: N/A
- CAS DataBase Reference: Bicyclo[4.2.0]octa-1,3,5-trien-7-yl(methyl) ketone O-allyl oxime(CAS DataBase Reference)
- NIST Chemistry Reference: Bicyclo[4.2.0]octa-1,3,5-trien-7-yl(methyl) ketone O-allyl oxime(6813-95-2)
- EPA Substance Registry System: Bicyclo[4.2.0]octa-1,3,5-trien-7-yl(methyl) ketone O-allyl oxime(6813-95-2)
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Safety Data
- Hazard Codes: N/A
- Statements: N/A
- Safety Statements: N/A
- WGK Germany:
- RTECS:
- HazardClass: N/A
- PackingGroup: N/A
- Hazardous Substances Data: 6813-95-2(Hazardous Substances Data)
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Check Digit Verification of cas no
The CAS Registry Mumber 6813-95-2 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 6,8,1 and 3 respectively; the second part has 2 digits, 9 and 5 respectively.Calculate Digit Verification of CAS Registry Number 6813-95:
(6*6)+(5*8)+(4*1)+(3*3)+(2*9)+(1*5)=112
112 % 10 = 2
So 6813-95-2 is a valid CAS Registry Number.
InChI:InChI=1/C13H15NO/c1-3-8-15-14-10(2)13-9-11-6-4-5-7-12(11)13/h3-7,13H,1,8-9H2,2H3/b14-10+
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Bicyclo[4.2.0]octa-1,3,5-trien-7-yl(methyl) ketone O-allyl oxime
