2-Bromopropan-1-ol

Base Information

• Chemical Name: 2-Bromopropan-1-ol
• CAS No.: 598-18-5
• Molecular Formula: C3H7 Br O
• Molecular Weight: 138.992
• European Community (EC) Number: 209-921-4
• DSSTox Substance ID: DTXSID80975207
• Nikkaji Number: J252.486D
• Mol file: 598-18-5.mol

Synonyms:2-Bromopropan-1-ol;598-18-5;2-BROMO-1-PROPANOL;1-propanol, 2-bromo-;EINECS 209-921-4;2-bromopropanol;2-bromo-propanol;2-bromo propan-1-ol;2-bromo-propan-1-ol;SCHEMBL180102;(+/-)-2-Bromo-1-propanol;DTXSID80975207;MFCD00078663;AKOS025295519;AS-56959;CS-0061061;EN300-175186;W17591;A927913

Chemical Property of 2-Bromopropan-1-ol

Chemical Property:

• Vapor Pressure: 1.99mmHg at 25°C
• Boiling Point: 144.8°Cat760mmHg
• PKA: 13.89±0.10(Predicted)
• Flash Point: 54.9°C
• PSA: 20.23000
• Density: 1.559g/cm³
• LogP: 0.76210
• Storage Temp.: Hygroscopic, Refrigerator, under inert atmosphere
• Solubility.: Chloroform (Sparingly), Methanol (Slightly)
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 137.96803
• Heavy Atom Count: 5
• Complexity: 22.9

Purity/Quality:

99% ^*data from raw suppliers

2-Bromo-1-propanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CO)Br
• Uses: 2-Bromo-1-propanol is used in the epoxide productions from Flavobacterium.

Technology Process of 2-Bromopropan-1-ol

There total 17 articles about 2-Bromopropan-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: 80.0%

α-bromopropionyl bromide (563-76-8) → 2-bromopropanol (598-18-5)

Guidance literature:

With lithium aluminium tetrahydride; In diethyl ether; for 15h; Ambient temperature;

DOI:10.1021/jo00057a034

Reference yield: 80.0%

methyloxirane (75-56-9,16033-71-9) → 1-bromo-2-propanol (19686-73-8) + 2-bromopropanol (598-18-5)

Guidance literature:

With ammonium cerium(IV) nitrate; tetrabutylammomium bromide; In tert-butyl alcohol; for 2h; Ambient temperature;

DOI:10.1080/00397919708003362

Reference yield: 63.0%

propylene glycol (57-55-6,63625-56-9) → 2-bromopropanol (598-18-5)

Guidance literature:

With hydrogen bromide; for 8h; Heating;

DOI:10.1080/00304949709355185

upstream raw materials:

α-bromopropionyl bromide

1-amino-2-bromopropane

bromo-2 propanal

propylene glycol

Downstream raw materials:

2-Propylenglycolmonostearat

2-bromopropyl benzyl(phenyl)carbamate

1-(3-bromo-propoxy)-2-chloro-benzene

2-(phenylthio)propan-1-ol

Refernces

• 1、 Owston, Nathan A.,Fu, Gregory C.. "Asymmetric alkyl-alkyl cross-couplings of unactivated secondary alkyl electrophiles: Stereoconvergent suzuki reactions of racemic acylated halohydrins". supporting information; experimental part. p. 11908 - 11909. Retrieved 2010/11/04.
• 2、 Soroka, Miros?aw,Goldeman, Waldemar. "Reinvestigation of the conversion of epoxides into halohydrins with elemental halogen catalysed by thiourea". . p. 4233 - 4235. Retrieved 2007/10/03.