5-AMINO-2-CHLOROBENYL ALCOHOL, 97%

Base Information

• Chemical Name: 5-AMINO-2-CHLOROBENYL ALCOHOL, 97%
• CAS No.: 89951-56-4
• Molecular Formula: C7H8ClNO
• Molecular Weight: 157.6
• Hs Code.: 2922199090
• European Community (EC) Number: 685-077-4
• DSSTox Substance ID: DTXSID60544011
• Nikkaji Number: J1.383.153J
• Wikidata: Q82420984
• Mol file: 89951-56-4.mol

Synonyms:5-amino-2chloro benzyl alcohol;5-Amino-2-chlorobenzyl alcohol;

Chemical Property of 5-AMINO-2-CHLOROBENYL ALCOHOL, 97%

Chemical Property:

• Vapor Pressure: 9.03E-05mmHg at 25°C
• Melting Point: 119-123 °C(lit.)
• Refractive Index: 1.63
• Boiling Point: 326 °C at 760 mmHg
• Flash Point: 151 °C
• PSA: 46.25000
• Density: 1.341 g/cm³
• LogP: 1.99570
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 157.0294416
• Heavy Atom Count: 10
• Complexity: 110

Purity/Quality:

97% ^*data from raw suppliers

(5-Amino-2-chlorophenyl)methanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1N)CO)Cl

Technology Process of 5-AMINO-2-CHLOROBENYL ALCOHOL, 97%

There total 5 articles about 5-AMINO-2-CHLOROBENYL ALCOHOL, 97% 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: 93.0%

2-chloro-5-nitrobenzyl alcohol (80866-80-4) → 4-chloro-5-hydroxymethyl aniline (89951-56-4)

Guidance literature:

With tin(ll) chloride; In water; ethyl acetate; at 20 - 70 ℃; for 26h;

Reference yield: 85.0%

2-chloro-5-nitrobenzaldehyde (6361-21-3) → 4-chloro-5-hydroxymethyl aniline (89951-56-4)

Guidance literature:

2-chloro-5-nitrobenzaldehyde; With 7% w/w Pd/C; In water; Green chemistry;

With sodium tetrahydroborate; water; for 0.233333h; Reflux; Green chemistry;

DOI:10.1007/s11164-021-04469-9

Reference yield:

methyl 2-chloro-5-aminobenzoate (42122-75-8) → 4-chloro-5-hydroxymethyl aniline (89951-56-4)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 0 - 66 ℃; for 2h;

DOI:10.1002/1521-3773(20001016)39:20<3681::AID-ANIE3681>3.0.CO;2-B

upstream raw materials:

2-chloro-5-nitrobenzyl alcohol

methyl 2-chloro-5-aminobenzoate

2-chloro-5-nitrobenzaldehyde

2-chloro-5-aminobenzoic acid

Downstream raw materials:

4-chloro-3-(hydroxymethyl)benzonitrile

5-azido-2-chlorobenzyl alcohol

tert-butyl N-[4-chloro-3-(hydroxymethyl)phenyl]carbamate

5-amino-2-chlorobenzaldehyde