Benz-13C6-aldehyde

Base Information

Chemical Name:Benz-13C6-aldehyde
CAS No.:153489-14-6
Molecular Formula:C7H6O
Molecular Weight:112.058
Hs Code.:
European Community (EC) Number:694-267-6
DSSTox Substance ID:DTXSID50448670
Nikkaji Number:J1.496.064C
Wikidata:Q82267763
Mol file:153489-14-6.mol

Synonyms:Benz-13C6-aldehyde;153489-14-6;(1,2,3,4,5,6-13C6)cyclohexatrienecarbaldehyde;benz-13c 6-aldehyde;SCHEMBL10051945;DTXSID50448670;Benz-13C6-aldehyde, 99 atom % 13C

Suppliers and Price of Benz-13C6-aldehyde

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
Benzaldehyde-(phenyl-13C6)
5mg
$ 85.00

Sigma-Aldrich
Benz-13C6-aldehyde 99 atom %
500mg
$ 1250.00

American Custom Chemicals Corporation
BENZ-13C6-ALDEHYDE 95.00%
500MG
$ 1922.21

Total 3 raw suppliers

Chemical Property of Benz-13C6-aldehyde

Chemical Property:

Melting Point:-26 °C(lit.)
Boiling Point:178-179 °C(lit.)
Flash Point:145 °F
PSA：17.07000
Density:1.103 g/mL at 25 °C
LogP:1.49910
XLogP3:1.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:112.06199382
Heavy Atom Count:8
Complexity:72.5

Purity/Quality:

99% (CP); 99% atom 13C ^*data from raw suppliers

Benzaldehyde-(phenyl-13C6) ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xn
Statements: 22
Safety Statements: 24

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)C=O
Isomeric SMILES:[13CH]1=[13CH][13CH]=[13C]([13CH]=[13CH]1)C=O

Technology Process of Benz-13C6-aldehyde

There total 2 articles about Benz-13C6-aldehyde which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 89059-34-7
[¹³C₆]phenol

: 153489-14-6
[¹³C₆]-benzaldehyde

Guidance literature:: Multi-step reaction with 2 steps

1: hydrogen bromide

With hydrogen bromide; 2: |Bouveault Aldehyde Synthesis;
DOI:10.1002/jlcr.3193