4-Butoxybutan-1-ol

Base Information

• Chemical Name: 4-Butoxybutan-1-ol
• CAS No.: 4161-24-4
• Molecular Formula: C8H18O2
• Molecular Weight: 146.23
• Hs Code.: 2909499000
• European Community (EC) Number: 831-223-9
• DSSTox Substance ID: DTXSID00274663
• Nikkaji Number: J55.483I
• Wikidata: Q82004079
• Mol file: 4161-24-4.mol

Synonyms:4-butoxybutan-1-ol;4161-24-4;4-Butoxy-1-butanol;4-Butoxybutanol;1-BUTANOL, 4-BUTOXY-;1,4-Tetrabutyleneglycol monobutyl ether;4-Butoxy-1-butanol #;butylene glycol n-butyl ether;SCHEMBL223964;Butylene glycol monobutyl ether;4-(BUTYLOXY)-1-BUTANOL;DTXSID00274663;OBXQRJAQMQQZMY-UHFFFAOYSA-N;MFCD16824159;AKOS008152677;s11917;AS-81021;CS-0217821;EN300-86351;Z993012624

Chemical Property of 4-Butoxybutan-1-ol

Chemical Property:

• Vapor Pressure: 0.0249mmHg at 25°C
• Boiling Point: 219.5°Cat760mmHg
• PKA: 15.08±0.10(Predicted)
• Flash Point: 62.5°C
• PSA: 29.46000
• Density: 0.889g/cm³
• LogP: 1.57560
• Storage Temp.: Refrigerator
• Solubility.: Chloroform (Sparingly), Methanol (Slightly)
• XLogP3: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 7
• Exact Mass: 146.130679813
• Heavy Atom Count: 10
• Complexity: 55.2

Purity/Quality:

99%, ^*data from raw suppliers

4-Butoxybutanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCOCCCCO
• Uses: 4-butoxybutan-1-ol is used in the synthesis of biomedical polyurethane for application as scaffold materials.

Technology Process of 4-Butoxybutan-1-ol

There total 1 articles about 4-Butoxybutan-1-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:

2-propyl-[1,3]dioxepane (38503-12-7) → Butane-1,4-diol (110-63-4) + 4-butoxy-butan-1-ol (4161-24-4)

Guidance literature:

With 2-propyl-[1,3]dioxane; lithium aluminium tetrahydride; boron trichloride; Yield given. Multistep reaction. Yields of byproduct given. Title compound not separated from byproducts; 1.) CH₂Cl₂, 0.2 h, 2.) Et₂O, 30 min;

DOI:10.1039/P19810001807

Reference yield:

diazomethane (186581-53-3,908094-01-9,334-88-3) + 4-butoxy-butan-1-ol (4161-24-4) → methyl 4-butoxybutanoate (29006-06-2)

Guidance literature:

Multistep reaction; (i) CrO₃, H₂SO₄, acetone, (ii) /BRN= 102415/;

DOI:10.1021/jo00812a017

upstream raw materials:

2-propyl-[1,3]dioxepane

Downstream raw materials:

methyl 4-butoxybutanoate

Refernces