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Spiro[3.3]heptan-1-one is a bicyclic ketone compound characterized by its unique spiro-fused seven-membered ring structure. It is known for its versatile reactivity and compatibility with functional groups, making it a valuable building block in the synthesis of various organic compounds and pharmaceuticals.

63049-05-8

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63049-05-8 Usage

Uses

Used in Pharmaceutical Industry:
Spiro[3.3]heptan-1-one is used as a key intermediate in the synthesis of natural products and medicinal compounds. Its unique structure and reactivity contribute to the development of new chemical reactions and synthetic methodologies, enhancing the discovery and production of novel pharmaceuticals.
Used in Agricultural Industry:
Spiro[3.3]heptan-1-one is used as a precursor in the synthesis of spirotetramat, a derivative of spirotetronate with insecticidal and acaricidal activities. This makes it a valuable component in the development of pesticides for agricultural applications, helping to protect crops and improve overall yield.

Check Digit Verification of cas no

The CAS Registry Mumber 63049-05-8 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 6,3,0,4 and 9 respectively; the second part has 2 digits, 0 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 63049-05:
(7*6)+(6*3)+(5*0)+(4*4)+(3*9)+(2*0)+(1*5)=108
108 % 10 = 8
So 63049-05-8 is a valid CAS Registry Number.

63049-05-8SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 13, 2017

Revision Date: Aug 13, 2017

1.Identification

1.1 GHS Product identifier

Product name spiro[3.3]heptan-3-one

1.2 Other means of identification

Product number -
Other names Spiro[3.3]heptan-1-one

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:63049-05-8 SDS

63049-05-8Relevant academic research and scientific papers

Competitive 1,2-C Atom Shifts in the Strained Carbene Spiro[3.3]hept-1-ylidene Explained by Distinct Ring-Puckered Conformers

Rosenberg, Murray G.,Schrievers, Theodor,Brinker, Udo H.

, p. 12388 - 12400 (2016/12/23)

Spiro[3.3]hept-1-ylidene is a markedly strained carbene reaction intermediate that was generated by high-vacuum flash pyrolysis (HVFP) of the corresponding p-tosylhydrazone sodium salt. Five hydrocarbons were produced from the Bamford-Stevens reactant in 82% overall yield. The carbene undergoes two [1,2]-sigmatropic rearrangements via competing 1,2-C atom shifts. Ring-contraction yields cyclopropylidenecyclobutane, while ring-expansion affords bicyclo[3.2.0]hept-1(5)-ene. The ring contraction is regiospecific despite the formation of some 1-methylenespiro[2.3]hexane. It does not originate from the carbene under HVFP conditions. Instead, it comes from a methylenecyclopropane-type rearrangement of chemically activated cyclopropylidenecyclobutane. Similarly, some chemically activated bicyclo[3.2.0]hept-1(5)-ene rearranges to 1,2-dimethylenecyclopentane via electrocyclic ring-opening. Accounting for the conversion of primary products to secondary ones, relative yields indicate that ring-contraction within the carbene prevails over ring-expansion by a factor of 6.7:1. Computational chemistry was used to assess the structures, conformations, energies, strain energies, transition states, and activation energies of these rearrangements with the goal of explaining product selectivities. The dual-ringed carbene is predicted to assume four distinct geometric conformations that have a bearing on transition-state selection. The reactive cyclobutylidene units of two conformers are significantly puckered, like cyclobutylidene itself, while those of the other two are flatter. The selectivity of the title carbene is compared with that of spiro[2.3]hex-4-ylidene.

The chemistry of small-ring compounds. Part 47. Small-ring interference in the ozonolysis of cyclopropylidenecycloalkanes

Heuvel, C. J. M. van den,Hofland, A.,Velzen, J. C. van,Steinberg, H.,Boer, Th. J. de

, p. 233 - 240 (2007/10/02)

Ozonolysis of olefins Ia-c containing a cyclpropylidene group, does not follow the classical Criegee mechanism but gives the anomalous products IIa-c, IIIa-c, IVa-c, and Va-c, as outlined in Scheme 2.None of these oxidation products contains the cycloprop

Cyclopropylidenecyclanes Oxydation par l'acide peroxycarboximidique

Bertrand, Marcel,Meou, Alain,Tubul, Arlette

, p. 3691 - 3694 (2007/10/02)

The title reaction gives a mixture of four compounds .A 2-cyclohexyllideneoxetane is invoked as intermediary to account for the unusual lactone formation.

Polyspiranes, 6. Attempted Direct Homologation of Trispirodecan-10-one and 10-(Benzenesulfonimido>trispirodecane with Diazocyclopropane

Fitjer, Lutz,Wehle, Detlef

, p. 1061 - 1069 (2007/10/02)

The reaction of the ketone 1, m = 0, with diazocyclopropane proceeds predominantly to the spiroalkylation product 9, m = 0, with a minor amount of the homologation product 1, m = 1.The use of the sulfonimide 23 significantly increases the yield of 1, m =

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