1-[(Dibenzylamino)methyl]cyclopropan-1-ol

Base Information

• Chemical Name: 1-[(Dibenzylamino)methyl]cyclopropan-1-ol
• CAS No.: 428855-17-8
• Molecular Formula: C18H21 N O
• Molecular Weight: 267.371
• DSSTox Substance ID: DTXSID90573531
• Wikidata: Q82462269
• Mol file: 428855-17-8.mol

Synonyms:428855-17-8;1-[(Dibenzylamino)methyl]cyclopropanol;1-[(dibenzylamino)methyl]cyclopropan-1-ol;1-[[bis(Phenylmethyl)amino]methyl] cyclopropanol;MFCD07367843;1-((dibenzylamino)methyl)cyclopropanol;1-((dibenzylamino)methyl)cyclopropan-1-ol;1-[(N-bis-Benzyl)aminomethyl]-Cyclopropanol;SCHEMBL17700363;DTXSID90573531;QILKRCMMHALAJX-UHFFFAOYSA-N;BCP21487;AKOS015904218;AB92005;AC-13999;AM803900;CS-12004;SY035235;CS-0036853;1-[[Bis-(phenylmethyl)amino]methyl]cyclopropanol;A826050

Chemical Property of 1-[(Dibenzylamino)methyl]cyclopropan-1-ol

Chemical Property:

• Vapor Pressure: 1.41E-06mmHg at 25°C
• Refractive Index: 1.626
• Boiling Point: 383.8°Cat760mmHg
• PKA: 14.86±0.20(Predicted)
• Flash Point: 175.9°C
• PSA: 23.47000
• Density: 1.155g/cm³
• LogP: 3.21370
• Storage Temp.: 2-8°C(protect from light)
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 267.162314293
• Heavy Atom Count: 20
• Complexity: 268

Purity/Quality:

99% ^*data from raw suppliers

1-[(Dibenzylamino)methyl]cyclopropanol 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC1(CN(CC2=CC=CC=C2)CC3=CC=CC=C3)O

Technology Process of 1-[(Dibenzylamino)methyl]cyclopropan-1-ol

There total 6 articles about 1-[(Dibenzylamino)methyl]cyclopropan-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: 90.0%

N,N-dibenzylglycine ethyl ester (77385-90-1) + ethylmagnesium bromide (925-90-6) → 1-((diphenylmethylamino)methyl)cyclopropan-1-ol (428855-17-8)

Guidance literature:

With titanium(IV) isopropylate; In diethyl ether; at 20 ℃;

DOI:10.1023/A:1013158900003

Reference yield:

N,N-dibenzylglycine ethyl ester (77385-90-1) → 1-((diphenylmethylamino)methyl)cyclopropan-1-ol (428855-17-8)

Guidance literature:

With titanium(IV) isopropylate; methylmagnesium bromide; In tetrahydrofuran; diethyl ether; at 0 - 20 ℃; Inert atmosphere;

Reference yield:

(dibenzylamino)acetic acid methyl ester (94226-55-8) + ethylmagnesium bromide (925-90-6) → 1-((diphenylmethylamino)methyl)cyclopropan-1-ol (428855-17-8)

Guidance literature:

With titanium(IV) isopropylate; magnesium; In diethyl ether; at 15 - 20 ℃; Inert atmosphere;

upstream raw materials:

N,N-dibenzylglycine ethyl ester

ethylmagnesium bromide

dibenzylamine

benzyl chloride

Downstream raw materials:

1-(aminomethyl)cyclopropan-1-ol

Refernces

• 1、 -. "FGFR4 INHIBITOR, PREPARATION METHOD THEREFOR, AND APPLICATIONS THEREOF". Paragraph 0128; 0129. . Retrieved 2019/02/28.
• 2、 -. "Intermediate compound of medicine LB80380 and preparing method and application thereof". Paragraph 0194; 0195; 0196; 0197. . Retrieved 2017/05/12.