propyl-1-14C alcohol

Base Information

• Chemical Name: propyl-1-14C alcohol
• CAS No.: 16504-75-9
• Molecular Formula: C₃H₈O
• Molecular Weight: 62.0849
• DSSTox Substance ID: DTXSID10480192
• Wikidata: Q82314804
• Mol file: 16504-75-9.mol

Synonyms:propyl-1-14C alcohol;16504-75-9;(114C)propan-1-ol;PROPANOL-N, [1-14C];Propanol-N,[1-14c];DTXSID10480192

Chemical Property of propyl-1-14C alcohol

Chemical Property:

• PSA: 20.23000
• LogP: 0.38870
• Storage Temp.: 2-8°C
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 62.06075686
• Heavy Atom Count: 4
• Complexity: 7.2

Purity/Quality:

Safty Information:

• Hazard Codes: F,Xi
• Statements: 11-41-67
• Safety Statements: 7-16-24-26-39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCCO
• Isomeric SMILES: CC[14CH2]O

Technology Process of propyl-1-14C alcohol

There total 3 articles about propyl-1-14C alcohol 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: 70.0%

[1-14C]propionic acid (4561-18-6) → 1-[1-14C]propanol (16504-75-9)

Guidance literature:

With lithium aluminium tetrahydride; In diethyl ether; for 1h; Heating;

DOI:10.1002/(SICI)1099-1344(199805)41:5<411::AID-JLCR94>3.0.CO;2-7

Reference yield:

[14C]carbon dioxide (51-90-1) + ethylmagnesium bromide (925-90-6) → 1-[1-14C]propanol (16504-75-9)

Guidance literature:

With diethyl ether; Kochen des Natriumsalzes der entstandenen C₂H₅¹⁴CO₂H mit Propylalkohol und konz.H₂SO₄ in Benzol und Hydrieren des Reaktionsprodukts in Gegenwart von Kupferchromit bei 250grad unter Druck;

Reference yield:

→ 1-[1-14C]propanol (16504-75-9)

Guidance literature:

DOI:10.1021/jo01350a050 DOI:10.1021/jo01351a641 DOI:10.1039/jr9630001930

upstream raw materials:

[1-14C]propionic acid

[14C]carbon dioxide

ethylmagnesium bromide