2-Chloro-2-propen-1-ol

Base Information

• Chemical Name: 2-Chloro-2-propen-1-ol
• CAS No.: 5976-47-6
• Molecular Formula: C3H5 Cl O
• Molecular Weight: 92.5251
• Hs Code.: 2905599890
• NSC Number: 508743,87536
• UNII: V60IX5IR93
• DSSTox Substance ID: DTXSID2073984
• Nikkaji Number: J51.039D
• Wikidata: Q82002536
• Mol file: 5976-47-6.mol

Synonyms:2-chloro-2-propen-1-ol;2-chloroallyl alcohol;2-chloroallylalcohol

Chemical Property of 2-Chloro-2-propen-1-ol

Chemical Property:

• Vapor Pressure: 2.88mmHg at 25°C
• Refractive Index: n20/D 1.459(lit.)
• Boiling Point: 133-134oC(lit.)
• PKA: 11.45±0.10(Predicted)
• Flash Point: 130 °F
• PSA: 20.23000
• Density: 1.162 g/mL at 25oC(lit.)
• LogP: 0.73120
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 92.0028925
• Heavy Atom Count: 5
• Complexity: 42.2

Purity/Quality:

98%,99%, ^*data from raw suppliers

2-Chloroallyl alcohol, technical grade 90% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn,Xi
• Hazard Codes: Xn,Xi
• Statements: 10-20/21/22
• Safety Statements: 16-26-27-36/37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C=C(CO)Cl
• Uses: 2-Chloro-2-propen-1-ol (2-chloropropenol) may be employed as carbon supplement for the growth of Pseudomonas strains. It may be used in the preparation of 2-(4-octylphenyl)prop-2-en-1-ol.

Technology Process of 2-Chloro-2-propen-1-ol

There total 5 articles about 2-Chloro-2-propen-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:

1,3-Dichloropropane (142-28-9) + 1-chloro-3-hydroxypropane (627-30-5) → glycidyl methyl ether (930-37-0) + 1,2-Epoxyhexane (1436-34-6) + 2,3-Dichloroprop-1-ene (78-88-6) + 2-chloroallyl alcohol (5976-47-6) + 1,2,2-trichloropropane (3175-23-3) + 1,2-Dichloropropane (26198-63-0,78-87-5) + cis-1,3-Dichloropropene (10061-01-5) + 1,2,3-trichloro-1-propene (13116-58-0) + (1Z)-1,2,3-trichloroprop-1-ene (96-19-5,13116-58-0,13116-57-9) + 1,3,3-trichloro-propene (2953-50-6) + 1t,3,3-trichloro-propene (2598-01-8) + chlorodibromomethane (124-48-1) + 1,1,2-trichloropropane (598-77-6) + 2,3-Dichloro-1-propanol (616-23-9) + 1,3-Dichloro-2-propanol (96-23-1) + 1,2,3-trichloropropane (96-18-4) + 3,3-dichloropropene (563-57-5) + 3,3-dichloroallyl chloride (2567-14-8) + acetaldehyde (75-07-0,9002-91-9) + allyl alcohol (107-18-6) + hydroxy-2-propanone (116-09-6) + chloroacetone (78-95-5) + cyclopentanone (120-92-3) + chlorobenzene (108-90-7) + isopropyl alcohol (67-63-0,8013-70-5) + 3-monochloro-1,2-propanediol (96-24-2) + acrolein (107-02-8,25068-14-8) + epichlorohydrin (106-89-8,24969-06-0,13403-37-7) + (E)-1,3-dichloro-prop-1-ene (10061-02-6)

Guidance literature:

With sodium hydroxide; water; at 45 - 62.4 ℃; under 112.511 - 750.075 Torr; Product distribution / selectivity;

Reference yield:

1,2,3-trichloropropane (96-18-4) → 2,3-Dichloroprop-1-ene (78-88-6) + 2-chloroallyl alcohol (5976-47-6)

Guidance literature:

DOI:10.1021/ja01855a055

Reference yield:

1,2,3-trichloropropane (96-18-4) → 2,3-Dichloroprop-1-ene (78-88-6) + 2-chloroallyl alcohol (5976-47-6)

Guidance literature:

DOI:10.1021/ja01855a055

upstream raw materials:

hydrogenchloride

propargyl alcohol

tetrachloromethane

1,2,3-trichloropropane

Downstream raw materials:

phenyl-carbamic acid-(2-chloro-allyl ester)

(2-chloro-allyl)-vinyl ether

2-Chlorallyl-N-pivaloyl-carbamat

2-Chlorallyl-N-(p-toluoyl)-carbamat

Refernces