3-(4-Methylphenyl)propan-1-amine

Base Information

• Chemical Name: 3-(4-Methylphenyl)propan-1-amine
• CAS No.: 54930-39-1
• Molecular Formula: C10H15N
• Molecular Weight: 149.236
• Hs Code.: 2921499090
• DSSTox Substance ID: DTXSID60502712
• Wikidata: Q82355970
• Mol file: 54930-39-1.mol

Synonyms:3-(4-methylphenyl)propan-1-amine;54930-39-1;3-(p-Tolyl)propan-1-amine;4-METHYL-BENZENEPROPANAMINE;3-(4-methylphenyl)propanamine;SCHEMBL3728478;[3-(4-methylphenyl)propyl]amine;DTXSID60502712;NUWCDHQYCLUEDS-UHFFFAOYSA-N;MFCD07374075;AKOS000345100;AB38682;BS-12140;3-(4-METHYLPHENYL)-1-PROPANAMINE;FT-0747237;3-(4-Methylphenyl)propan-1-amine, AldrichCPR;C78299;EN300-1235035;F9995-2107

Chemical Property of 3-(4-Methylphenyl)propan-1-amine

Chemical Property:

• Vapor Pressure: 0.041mmHg at 25°C
• Boiling Point: 239.219°C at 760 mmHg
• Flash Point: 103.403°C
• PSA: 26.02000
• Density: 0.94g/cm³
• LogP: 2.58660
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 149.120449483
• Heavy Atom Count: 11
• Complexity: 93

Purity/Quality:

98%min ^*data from raw suppliers

3-(4-Methylphenyl)propan-1-amine Aldrich ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)CCCN

Technology Process of 3-(4-Methylphenyl)propan-1-amine

There total 11 articles about 3-(4-Methylphenyl)propan-1-amine 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: 73.0%

→ 3-(4-methylphenyl)propanamine (54930-39-1)

Guidance literature:

Reference yield:

1-cyano-2-(4'-methylphenyl)ethane (32327-69-8) → 3-(4-methylphenyl)propanamine (54930-39-1)

Guidance literature:

With ethanol; sodium;

Reference yield:

3-(4'-fluorophenyl)propanenitrile (25468-86-4) → 3-(4-methylphenyl)propanamine (54930-39-1)

Guidance literature:

With lithium aluminium tetrahydride; In diethyl ether; at 0 ℃; for 2h; Reflux;

DOI:10.1021/jo3020566

upstream raw materials:

1-cyano-2-(4'-methylphenyl)ethane

[1,3]oxazinan-2-one

toluene

(2-bromoethyl)-4-fluorobenzene

Downstream raw materials:

2-Cyclohexanecarbonyl-11-methyl-2,3,6,7,8,12b-hexahydro-1H-benzo[3,4]azepino[1,2-a]pyrazin-4-one

3-(4-fluorophenyl)propyl carbamic acid methyl ester

8-fluoro-2,3,4,5-tetrahydro-benzo[c]azepin-1-one

3-(4-fluorophenyl)propan-1-amine