4-Methoxybenzylamine

Base Information

• Chemical Name: 4-Methoxybenzylamine
• CAS No.: 2393-23-9
• Molecular Formula: C8H11NO
• Molecular Weight: 137.181
• Hs Code.: 29222900
• NSC Number: 9269
• UNII: 2M6QLM4NWE
• DSSTox Substance ID: DTXSID2062371
• Nikkaji Number: J101.237A
• Wikidata: Q27121634
• ChEMBL ID: CHEMBL12720
• Mol file: 2393-23-9.mol

Synonyms:4-methoxybenzylamine;p-methoxybenzylamine

Chemical Property of 4-Methoxybenzylamine

Chemical Property:

• Appearance/Colour: clear colorless to slightly yellow liquid
• Vapor Pressure: 0.0472mmHg at 25°C
• Melting Point: -10 °C
• Refractive Index: n20/D 1.546(lit.)
• Boiling Point: 236.499 °C at 760 mmHg
• PKA: 9.30±0.10(Predicted)
• Flash Point: 98.8 °C
• PSA: 35.25000
• Density: 1.028 g/cm³
• LogP: 1.85420
• Storage Temp.: Store below +30°C.
• Sensitive.: Air Sensitive
• Water Solubility.: It is highly soluble in water.
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 137.084063974
• Heavy Atom Count: 10
• Complexity: 87.3

Purity/Quality:

99% ^*data from raw suppliers

4-Methoxybenzenemethanamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C
• Statements: 34-37-22
• Safety Statements: 26-36/37/39-45-27

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Nitrogen Compounds -> Amines, Aromatic
• Canonical SMILES: COC1=CC=C(C=C1)CN
• Uses: 4-Methoxybenzylamine is an important raw material and intermediate used in Organic Synthesis, Pharmaceuticals, Agrochemicals and Dyestuff. It is also used fine chemical intemediate.

Technology Process of 4-Methoxybenzylamine

There total 86 articles about 4-Methoxybenzylamine 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: 100.0%

4-methoxybenzonitrile (874-90-8) → 4-methoxy-benzylamine (2393-23-9)

Guidance literature:

With hydrogen; aluminum oxide; silica gel; nickel; In methanol; ammonia; at 120 ℃; for 6h; under 7600 Torr;

DOI:10.1055/s-2001-17481

Reference yield: 97.0%

4-methoxy-benzaldehyde (123-11-5) → 4-methoxy-benzylamine (2393-23-9)

Guidance literature:

With nickel(II) tetrafluoroborate hexahydrate; ammonia; hydrogen; bis(2-diphenylphosphinoethyl)phenylphosphine; In 2,2,2-trifluoroethanol; at 100 ℃; for 24h; chemoselective reaction;

DOI:10.1039/d0sc01084g

Reference yield: 91.0%

N-(2-(4-methoxyphenyl)-2-oxoethyl)picolinamide (77250-70-5) → 4-methoxy-benzylamine (2393-23-9)

Guidance literature:

N-(2-(4-methoxyphenyl)-2-oxoethyl)picolinamide; With hydrogenchloride; In water; at 20 ℃; for 0.0833333h; Inert atmosphere;

With zinc; In water; at 20 ℃; for 16h; Inert atmosphere;

DOI:10.1016/j.tetlet.2016.05.068

upstream raw materials:

p-methoxyl benzaldoxime

4-methoxyphenylacetamide

hexamethylenetetramine

p-methoxybenzyl chloride

Downstream raw materials:

N-(4-methoxybenzyl)pyrimidin-2-amine

(4-methoxy-benzyl)-(6-methyl-pyridazin-3-yl)-amine

2-[(4-methoxyphenyl)methyl]-1H-isoindole-1,3(2H)-dione

1,3-bis(4-methoxyphenylmethyl)thiourea

Refernces

• 1、 An, Duk Keun,Jaladi, Ashok Kumar,Kim, Hyun Tae,Yi, Jaeeun. "Deoxygenative hydroboration of primary, secondary, and tertiary amides: Catalyst-free synthesis of various substituted amines". . . Retrieved 2021/11/17.
• 2、 Zhang, Shaoke,Duan, Ya-Nan,Qian, Yu,Tang, Wenyue,Zhang, Runtong,Wen, Jialin,Zhang, Xumu. "Cobalt-Catalyzed Hydrogenative Transformation of Nitriles". . p. 13761 - 13767. Retrieved 2021/11/17.