Azetidin-2-ylmethyl-carbamic acid tert-butyl ester

Base Information

• Chemical Name: Azetidin-2-ylmethyl-carbamic acid tert-butyl ester
• CAS No.: 99724-21-7
• Molecular Formula: C9H18N2O2
• Molecular Weight: 186.254
• Hs Code.: 2933990090
• European Community (EC) Number: 850-583-8
• DSSTox Substance ID: DTXSID80558418
• Mol file: 99724-21-7.mol

Synonyms:99724-21-7;Azetidin-2-ylmethyl-carbamic acid tert-butyl ester;2-(N-Boc-aminomethyl)azetidine;tert-butyl N-(azetidin-2-ylmethyl)carbamate;tert-Butyl (azetidin-2-ylmethyl)carbamate;2-(Boc-aminomethyl)azetidine;MFCD06658350;(Azetidin-2-ylmethyl)carbamic acid tert-butyl ester hydrochloride;AZETIDIN-2-YLMETHYLCARBAMIC ACID TERT-BUTYL ESTER;(AZETIDIN-2-YLMETHYL)-CARBAMIC ACID TERT-BUTYL ESTER;Carbamic acid, (2-azetidinylmethyl)-, 1,1-dimethylethyl ester;tert-butyl azetidin-2-ylmethylcarbamate;SCHEMBL1398833;2-(N-Boc-aminomethyl) azetidine;DTXSID80558418;QMZBFSZZEGSSPH-UHFFFAOYSA-N;AB1180;AKOS006222258;SB15588;SB15589;SB40384;tert-Butyl(azetidin-2-ylmethyl)carbamate;AS-44533;SY028482;2-[(t-butoxycarbonylamino)methyl]azetidine;AM20120407;tert-Butyl [(azetidin-2-yl)methyl]carbamate;EN300-44816;tert-butyl N-[(azetidin-2-yl)methyl]carbamate;(Azetidin-2-ylmethyl)carbamicacidtert-butylester;A846070;(Azetidin-2-ylmethyl)-carbamic acid tert-butyl ester, AldrichCPR

Chemical Property of Azetidin-2-ylmethyl-carbamic acid tert-butyl ester

Chemical Property:

• Vapor Pressure: 0.0251mmHg at 25°C
• Refractive Index: 1.486
• Boiling Point: 247.9 °C at 760 mmHg
• PKA: 12.58±0.46(Predicted)
• Flash Point: 103.7 °C
• PSA: 50.36000
• Density: 1.04 g/cm³
• LogP: 1.59270
• Storage Temp.: 2-8°C(protect from light)
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 186.136827821
• Heavy Atom Count: 13
• Complexity: 187

Purity/Quality:

98%Min ^*data from raw suppliers

tert-ButylN-[(azetidin-2-yl)methyl]carbamate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)NCC1CCN1

Technology Process of Azetidin-2-ylmethyl-carbamic acid tert-butyl ester

There total 1 articles about Azetidin-2-ylmethyl-carbamic acid tert-butyl ester 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:

1-benzyl-2-[(t-butoxycarbonylamino)methyl]azetidine → (+/-)-2-(tert-butoxycarbonyl)aminomethylazetidine (99724-21-7,1638744-09-8)

Guidance literature:

With acetic acid; palladium; In tetrahydrofuran;

Reference yield: 28.0%

2,5-difluorobenzaldehyde (2646-90-4) + (+/-)-2-(tert-butoxycarbonyl)aminomethylazetidine (99724-21-7,1638744-09-8) → ((1-(4-fluoro-2-formylphenyl)azetidin-2-yl)methyl)tert-butyl carbamate

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 120 ℃; for 6h;

Reference yield:

2-phenylbenzenesulfonyl chloride (2688-90-6) + (+/-)-2-(tert-butoxycarbonyl)aminomethylazetidine (99724-21-7,1638744-09-8) → (2RS)-[1-(biphenyl-2-sulfonyl)azetidin-2-ylmethyl]carbamic acid tert-butyl ester (1007873-76-8)

Guidance literature:

With N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide; at 5 - 20 ℃;

Downstream raw materials:

ethyl 8-[2-(tert-butoxycarbonyl)aminomethyl-1-azetidinyl]-1-cyclopropyl-7-fluoro-9-methyl-4(H)-4-oxoquinolizinecarboxylate

8-[2-(tert-butoxycarbonyl)aminomethyl-1-azetidinyl]-1-cyclopropyl-7-fluoro-9-methyl-4(H)-4-oxoquinolizinecarboxylic acid

(2RS)-[1-(biphenyl-2-sulfonyl)azetidin-2-ylmethyl]carbamic acid tert-butyl ester

Refernces

• 1、 -. "Antibacterial agents". . . Retrieved 2008/06/13.