4-Cyclopropylaniline

Base Information

• Chemical Name: 4-Cyclopropylaniline
• CAS No.: 3158-71-2
• Molecular Formula: C9H11N
• Molecular Weight: 133.193
• Hs Code.: 2921420090
• European Community (EC) Number: 807-680-5
• DSSTox Substance ID: DTXSID10482595
• Wikidata: Q72460712
• Mol file: 3158-71-2.mol

Synonyms:4-Cyclopropylaniline;3158-71-2;4-cyclopropylBenzenamine;MFCD00019219;Benzenamine, 4-cyclopropyl-;4-cylopropyl-aniline;4-cyclopropyl aniline;4-cyclopropyl-aniline;4-(cyclopropyl)-aniline;4-cyclopropyl-phenylamine;SCHEMBL5284;DTXSID10482595;UBXDNWVNEZBDBN-UHFFFAOYSA-N;BCP30702;AKOS004118857;AM86858;SB75485;BS-13248;SY123887;BB 0223485;CS-0044997;FT-0699412;EN300-53941;A875852;4-Cyclopropylbenzenamine pound>>Benzenamine, 4-cyclopropyl-

Chemical Property of 4-Cyclopropylaniline

Chemical Property:

• Vapor Pressure: 0.017mmHg at 25°C
• Melting Point: 36℃
• Refractive Index: 1.5811 (589.3 nm 20℃)
• Boiling Point: 255.135oC at 760 mmHg
• PKA: 4.82±0.10(Predicted)
• Flash Point: 108.156oC
• PSA: 26.02000
• Density: 1.113g/cm3
• LogP: 2.72740
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• XLogP3: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 133.089149355
• Heavy Atom Count: 10
• Complexity: 110

Purity/Quality:

97% ^*data from raw suppliers

4-Cyclopropylaniline ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC1C2=CC=C(C=C2)N

Technology Process of 4-Cyclopropylaniline

There total 19 articles about 4-Cyclopropylaniline 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: 98.01%

4-nitrophenylcyclopropane (6921-44-4,34470-58-1) → 4-cyclopropylaniline (3158-71-2)

Guidance literature:

With iron; acetic acid; In methanol; water; at 100 ℃; for 2h;

Reference yield: 36.0%

cyclopropylbenzene (873-49-4) → 4-cyclopropylaniline (3158-71-2) + 2-cyclopropylaniline (3158-73-4)

Guidance literature:

cyclopropylbenzene;

With hydrogen; platinum(IV) oxide; In ethanol; for 6h; under 2327.17 Torr;

DOI:10.3109/00498259409043216

Reference yield: 31.0%

p-aminoiodobenzene (540-37-4) + cyclopropylboronic acid (411235-57-9) → 4-cyclopropylaniline (3158-71-2)

Guidance literature:

With potassium phosphate; palladium diacetate; tricyclohexylphosphine; In water; toluene; at 80 ℃; Inert atmosphere;

upstream raw materials:

4-nitrophenylcyclopropane

1-(4-Nitrophenyl)-1,3-dibrompropan

cyclopropylbenzene

1-(4-Nitrophenyl)-1,3-propyldinitrat

Downstream raw materials:

1-bromo-4-cyclopropylbenzene

4-Dimethylamino-phenyl-cyclopropan

4-cyclopropylphenol

C₂₂H₂₅NO₂