Monotridecyl phosphate

Base Information

• Chemical Name: Monotridecyl phosphate
• CAS No.: 5116-94-9
• Deprecated CAS: 70356-26-2
• Molecular Formula: C13H29 O4 P
• Molecular Weight: 280.345
• Hs Code.: 2919900090
• European Community (EC) Number: 270-201-8,260-396-8,225-850-1
• UN Number: 3265
• UNII: KNC97HUU04
• DSSTox Substance ID: DTXSID0042169
• Nikkaji Number: J203.311I
• Wikidata: Q27282342
• ChEMBL ID: CHEMBL3188547
• Mol file: 5116-94-9.mol

Synonyms:Monotridecyl phosphate;5116-94-9;Tridecyl acid phosphate;tridecyl dihydrogen phosphate;1-Tridecanol, dihydrogen phosphate;Tridecan-1-yl dihydrogen phosphate;UNII-KNC97HUU04;KNC97HUU04;1-Tridecanol, 1-(dihydrogen phosphate);DTXSID0042169;EINECS 225-850-1;EINECS 270-201-8;68412-63-5;56831-62-0;Phosphoric acid tridecyl ester;1-Tridecanol phosphate;SCHEMBL258319;1-Tridecanol,dihydrogenphosphate;CHEMBL3188547;DTXCID8022169;MONO-N-TRIDECYL PHOSPHATE;Tox21_301966;MFCD16661270;NCGC00255876-01;PHOSPHORIC ACID MONOTRIDECYL ESTER;SY299042;CAS-5116-94-9;W-110011;W-111127;Q27282342

Chemical Property of Monotridecyl phosphate

Chemical Property:

• Vapor Pressure: 1.7E-07mmHg at 25°C
• Refractive Index: n20/D 1.456
• Boiling Point: 399.4°Cat760mmHg
• Flash Point: 195.4°C
• PSA: 54.57000
• Density: 1.043g/cm³
• LogP: 11.56640
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 13
• Exact Mass: 280.18034640
• Heavy Atom Count: 18
• Complexity: 215
• Transport DOT Label: Corrosive

Purity/Quality:

99%, ^*data from raw suppliers

TRIDECYL PHOSPHATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C
• Statements: 34
• Safety Statements: 26-36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: UVCB
• Canonical SMILES: CCCCCCCCCCCCCOP(=O)(O)O

Technology Process of Monotridecyl phosphate

There total 1 articles about Monotridecyl phosphate 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:

1-dodecyl alcohol (112-53-8) → monotridecyl phosphate (5116-94-9)

Guidance literature:

With phosphoric acid; In toluene;

upstream raw materials:

1-dodecyl alcohol

Refernces