Butane-1-13C

Base Information

Chemical Name:Butane-1-13C
CAS No.:22612-53-9
Molecular Formula:C₄H₁₀
Molecular Weight:59.1124
Hs Code.:
European Community (EC) Number:693-174-8
DSSTox Substance ID:DTXSID70468153
Wikidata:Q82295262
Mol file:22612-53-9.mol

Synonyms:Butane-1-13C;(113C)butane;22612-53-9;Butane-1-13C, 99 atom % 13C;DTXSID70468153;Butane-1-13c,99 atom % 13c

Suppliers and Price of Butane-1-13C

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

Sigma-Aldrich
Butane-1-13C 99 atom %
100ml
$ 963.00

American Custom Chemicals Corporation
BUTANE-1-13C 95.00%
100ML
$ 3138.14

Total 1 raw suppliers

Chemical Property of Butane-1-13C

Chemical Property:

Vapor Pressure:51.6 psi ( 37.7 °C)
Melting Point:−138 °C(lit.)
Refractive Index:1.354
Boiling Point:−0.5 °C(lit.)
PSA：0.00000
Density:0.615g/cm³
LogP:1.80640
XLogP3:2.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:0
Rotatable Bond Count:1
Exact Mass:59.081605154
Heavy Atom Count:4
Complexity:2

Purity/Quality:

97% ^*data from raw suppliers

Butane-1-13C 99 atom % ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:F,Xi,F+
Statements: 11-36/37-12
Safety Statements: 16-26-33-38

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCC
Isomeric SMILES:CCC[13CH3]

Technology Process of Butane-1-13C

There total 3 articles about Butane-1-13C 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:

: 6532-48-5
methane

: 187737-37-7,13987-01-4,15220-87-8,9003-07-0,676-63-1,25085-53-4
propene

: 22612-53-9
1-(13)C-n-butane

Guidance literature:: silica gel; ruthenium; Yield given. Multistep reaction; 1.) 723 K, 2.) 323 K;
DOI:10.1039/c39920000345

Reference yield:

: 17251-62-6
¹³C-2-propane

: 6532-48-5
methane

: 6145-17-1
ethane-¹³C₁

: 17251-65-9
(1-13C)Propane

: 17251-66-0
1-⁽¹³⁾C-isobutane

: 22612-53-9
1-(13)C-n-butane

: 2-¹³C-n-butane

Guidance literature:: (3S,3aS,4S,4aS,6S,8aR,8bR,11S)-6,11-dihydroxy-3-methyl-12-methylene-2-oxo-4a,6-ethano-3,8b-prop-1-enoperhydroindeno[1,2-b]furan-4-carboxylic acid; at 299.9 ℃; Product distribution; various pressure, various time;
DOI:10.1002/recl.19941131009