1-Chloro-3-(hexadecyloxy)propan-2-ol

Base Information

• Chemical Name: 1-Chloro-3-(hexadecyloxy)propan-2-ol
• CAS No.: 18371-73-8
• Molecular Formula: C19H39ClO2
• Molecular Weight: 334.97
• Hs Code.: 2909499000
• DSSTox Substance ID: DTXSID20499098
• Nikkaji Number: J25.033C
• Mol file: 18371-73-8.mol

Synonyms:18371-73-8;1-Chloro-3-hexadecyloxy-2-propanol;1-chloro-3-hexadecoxypropan-2-ol;1-Chloro-3-(hexadecyloxy)propan-2-ol;SCHEMBL8958244;DTXSID20499098;CEKNQNBGGWOLAM-UHFFFAOYSA-N;3-(hexadecyloxy)-1-chloropropan-2-ol;3-chloro-2-hydroxypropyl hexadecyl ether

Chemical Property of 1-Chloro-3-(hexadecyloxy)propan-2-ol

Chemical Property:

• PSA: 29.46000
• LogP: 6.08400
• XLogP3: 7.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 18
• Exact Mass: 334.2638582
• Heavy Atom Count: 22
• Complexity: 200

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCOCC(CCl)O

Technology Process of 1-Chloro-3-(hexadecyloxy)propan-2-ol

There total 5 articles about 1-Chloro-3-(hexadecyloxy)propan-2-ol 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: 98.0%

1-Hexadecanol (36653-82-4,124-29-8) + epichlorohydrin (106-89-8,24969-06-0,13403-37-7) → 1-chloro-3-hexadecylhydroxy-2-propanol (18371-73-8)

Guidance literature:

With tin(IV) chloride; at 70 ℃; for 3h;

Reference yield: 96.0%

cetyl glycidyl ether (117606-92-5,121403-67-6,123483-78-3,15965-99-8) → 1-chloro-3-hexadecylhydroxy-2-propanol (18371-73-8)

Guidance literature:

With tetrabutyl-ammonium chloride; trifluoroacetic acid; In chloroform; at 20 ℃; for 1h;

DOI:10.1016/j.tetlet.2007.01.083

Reference yield: 80.0%

cetyl glycidyl ether (117606-92-5,121403-67-6,123483-78-3,15965-99-8) + benzoic acid (65-85-0,8013-63-6) → 1-chloro-3-hexadecylhydroxy-2-propanol (18371-73-8) + C26H44O4

Guidance literature:

With cetyltrimethylammonium chloride; In toluene; at 100 ℃; for 20h;

DOI:10.1039/c9ra09217j

upstream raw materials:

1-Hexadecanol

epichlorohydrin

cetyl glycidyl ether

benzoic acid

Downstream raw materials:

Phosphorochloridic acid 2-benzyloxy-3-hexadecyloxy-propyl ester 2-bromo-ethyl ester

Rac_. 1-O-Hexadecyl-2-O-benzylglycero-3-phosphocholin

2-hydroxy-3-(hexadecyloxy)-propyl 2-trimethylammonioethyl phosphate

2-O-Benzyl-1-O-hexadecyl-3-O-trityl-glycerin