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462-18-0

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462-18-0 Usage

Chemical Properties

White solid

Uses

7-Tridecanone is an isomer of 2-Tridecanone which is a flavor component of many food products. 7-Tridecanone, however, is much less distributed. It is also used to study the toxicity of narcotic industrial chemicals.

Synthesis Reference(s)

Journal of the American Chemical Society, 97, p. 6900, 1975 DOI: 10.1021/ja00856a069Tetrahedron Letters, 36, p. 3223, 1995 DOI: 10.1016/0040-4039(95)00519-I

Safety Profile

Moderately toxic by intravenousroute. A flammable liquid. When heated to decompositionit emits acrid smoke and irritating vapors.

Purification Methods

Crystallise the ketone from EtOH. [Beilstein 1 H 715.]

Check Digit Verification of cas no

The CAS Registry Mumber 462-18-0 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 4,6 and 2 respectively; the second part has 2 digits, 1 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 462-18:
(5*4)+(4*6)+(3*2)+(2*1)+(1*8)=60
60 % 10 = 0
So 462-18-0 is a valid CAS Registry Number.
InChI:InChI=1/C13H26O/c1-3-5-7-9-11-13(14)12-10-8-6-4-2/h3-12H2,1-2H3

462-18-0SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 11, 2017

Revision Date: Aug 11, 2017

1.Identification

1.1 GHS Product identifier

Product name 7-TRIDECANONE

1.2 Other means of identification

Product number -
Other names tridecan-7-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:462-18-0 SDS

462-18-0Relevant articles and documents

-

Asinger,F. et al.

, p. 425 - 435 (1979)

-

Long-Range Self-Assembly of an Electron-Deficient Hexaazatrinaphthylene with Out-of-Plane Substituents

Chen, Yi-Ru,Zhang, Yong-Yun,Yeh, Ming-Che,Luo, Ying-Ting,Ong, Chi Wi

, p. 613 - 618 (2019/12/24)

The unprecedented time-dependent long-range supramol-ecular assembly of electron-deficient hexaazatrinaphthylene (HATN) core based on peripheral crowding with three out-of-plane cyclic ketals is reported. The single-crystal X-ray structure of the diethyl derivative provided detailed information as to how four molecules in a repeating unit were packed in order to avoid steric crowding of the out-of-plane cyclic ketal side chain, providing locking and fastening for stabilizing the self-assembled structure. The polarizing optical microscopy (POM) and differential scanning calorimetry (DSC) did not instantaneously show any phase transition upon the cooling process. To our surprise, POM images showed a nucleation of spherulite up to 100 μm after 24 hour later. X-ray diffraction data further confirmed that these soft crystal formed a hexagonal-like crystal. The long-range self-assembly of the new material showed a slight red shift in the UV-vis absorption spectra and further substantiated by computational method.

Dehydrogenative Coupling of Benzylic and Aldehydic C-H Bonds

Ishida, Naoki,Kawasaki, Tairin,Murakami, Masahiro

supporting information, p. 3366 - 3370 (2020/03/06)

A photoinduced dehydrogenative coupling reaction between benzylic and aldehydic C-H bonds is reported. When a solution of an alkylbenzene and an aldehyde in ethyl acetate is irradiated with visible light in the presence of iridium and nickel catalysts, a coupled α-aryl ketone is formed with evolution of dihydrogen. An analogous C-C bond forming reaction occurs between a C-H bond next to the nitrogen of an N-methylamide and an aldehydic C-H bond to produce an α-amino ketone. These reactions provide a straightforward pathway from readily available materials leading to valued structural motifs of pharmacological relevance.

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