9-Octadecenoic acid, calcium salt (1:1), (9E)-

Base Information

• Chemical Name: 9-Octadecenoic acid, calcium salt (1:1), (9E)-
• CAS No.: 22333-94-4
• Molecular Formula: 2C₁₈H₃₃O₂*Ca
• Molecular Weight: 602.996
• DSSTox Substance ID: DTXSID401015781
• Mol file: 22333-94-4.mol

Synonyms:SCHEMBL29196;SCHEMBL11324221;DTXSID401015781;9-Octadecenoic acid, calcium salt (1:1), (9E)-;22333-94-4

Chemical Property of 9-Octadecenoic acid, calcium salt (1:1), (9E)-

Chemical Property:

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 28
• Exact Mass: 602.4587014
• Heavy Atom Count: 41
• Complexity: 228

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCCCCCC=CCCCCCCCC(=O)[O-].CCCCCCCCC=CCCCCCCCC(=O)[O-].[Ca+2]
• Isomeric SMILES: CCCCCCCC/C=C/CCCCCCCC(=O)[O-].CCCCCCCC/C=C/CCCCCCCC(=O)[O-].[Ca+2]

Technology Process of 9-Octadecenoic acid, calcium salt (1:1), (9E)-

There total 7 articles about 9-Octadecenoic acid, calcium salt (1:1), (9E)- 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:

sodium Oleate (143-19-1) → calcium oleate (142-17-6,22333-94-4,87147-61-3)

Guidance literature:

With calcium chloride; In water; at 40 ℃; Thermodynamic data; ΔH(reaction);

Reference yield:

cis-Octadecenoic acid (112-80-1,2027-47-6) + calcium stearate (1592-23-0) → calcium oleate (142-17-6,22333-94-4,87147-61-3)

Guidance literature:

cis-Octadecenoic acid; calcium stearate; at 100 ℃; for 1h;

at 350 ℃; for 5h; Inert atmosphere;

DOI:10.1166/jnn.2018.14208

Reference yield:

cis-Octadecenoic acid (112-80-1,2027-47-6) + carbon dioxide (124-38-9,18923-20-1) → calcium oleate (142-17-6,22333-94-4,87147-61-3) + calcium carbonate

Guidance literature:

cis-Octadecenoic acid; With calcium hydroxide; In propylene glycol; 1-dodecyl alcohol; D-80; water; at 88 ℃; for 0.833333h; pH=~ 10 - 12; Inert atmosphere;

carbon dioxide; In propylene glycol; 1-dodecyl alcohol; D-80; water; at 93 ℃; for 3h; Product distribution / selectivity;

upstream raw materials:

sodium Oleate

potassium oleate

cis-Octadecenoic acid

carbon dioxide

Refernces

• 1、 -. "A near-infrared response of bionic nano-preparation and preparation method and application thereof". Paragraph 0064-0066. . Retrieved 2022/01/12.
• 2、 -. "OVERBASED METAL CARBOXYLATE PRECURSOR AND PROCESS FOR MAKING". Page/Page column 10-11. . Retrieved 2009/12/05.