1-Methylcyclopropanemethanol

Base Information

• Chemical Name: 1-Methylcyclopropanemethanol
• CAS No.: 2746-14-7
• Molecular Formula: C5H10O
• Molecular Weight: 86.1338
• Hs Code.: 2906199090
• European Community (EC) Number: 626-559-6
• DSSTox Substance ID: DTXSID90181877
• Nikkaji Number: J236.396H
• Wikidata: Q72489777
• Mol file: 2746-14-7.mol

Synonyms:1-Methylcyclopropanemethanol;(1-Methylcyclopropyl)methanol;2746-14-7;MFCD00009682;(1-methyl-cyclopropyl)-methanol;Cyclopropanemethanol, 1-methyl-;1-methylcyclopropanmethanol;1-methylcyclopropylcarbinol;1-methylcyclopropyl-methanol;1-methyl-cyclopropanemethanol;1-methylcyclopropane-methanol;(1-methyl cyclopropyl)methanol;(1-Methylcyclopropyl)methanol #;PIZQWRXTMGASCZ-UHFFFAOYSA-;DTXSID90181877;1-Methylcyclopropanemethanol, 98%;AKOS005217441;CS-W000081;SB40876;AM803621;PS-16283;SY029659;FT-0634465;A20602;EN300-127943;J-016765;InChI=1/C5H10O/c1-5(4-6)2-3-5/h6H,2-4H2,1H3

Chemical Property of 1-Methylcyclopropanemethanol

Chemical Property:

• Vapor Pressure: 4.84mmHg at 25°C
• Melting Point: -15.1°C
• Refractive Index: n20/D 1.431(lit.)
• Boiling Point: 128.4 °C at 760 mmHg
• Flash Point: 33.9 °C
• PSA: 20.23000
• Density: 0.954 g/cm³
• LogP: 0.77880
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 86.073164938
• Heavy Atom Count: 6
• Complexity: 55

Purity/Quality:

98%,99%, ^*data from raw suppliers

(1-Methylcyclopropyl)methanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s): R10:
• Hazard Codes: R10:
• Statements: 10
• Safety Statements: 16-29-33

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC1(CC1)CO
• Uses: 1-Methylcyclopropanemethanol has been used in the preparation of (±)-2-(benzyloxycarbonylamino)-2-(1′-methylcyclopropyl)ethanamide.

Technology Process of 1-Methylcyclopropanemethanol

There total 11 articles about 1-Methylcyclopropanemethanol 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: 92.0%

1-Methyl-cyclopropanoic acid (6914-76-7) → 1-methylcyclopropanemethanol (2746-14-7)

Guidance literature:

With sodium tetrahydroborate; boron trifluoride diethyl etherate; In tetrahydrofuran; diethyl ether; at 20 ℃; for 2h;

Reference yield: 38.0%

2-methyl-4-trimethylstannyl-1-butene (17314-41-9) → 1-methylcyclopropanemethanol (2746-14-7)

Guidance literature:

epoxidation;

Reference yield:

methyl 1-methylcyclopropanecarboxylate (6206-25-3) → 1-methylcyclopropanemethanol (2746-14-7)

Guidance literature:

With lithium aluminium tetrahydride;

DOI:10.1021/ja01164a523

upstream raw materials:

1,1,1-tris(bromomethyl)ethane

methyl 1-methylcyclopropanecarboxylate

diiodomethane

3-hydroxy-2-methyl-1-propene

Downstream raw materials:

2-{3-methyl-1-[(1-methylcyclopropyl)methyl]-2-oxo-2,3-dihydro-1H-imidazo[4,5-b]pyridin-5-yl}benzonitrile

Refernces

• 1、 -. "COMPOUNDS AND METHOD OF USE". Paragraph 1121. . Retrieved 2019/09/06.
• 2、 Farmer, Luc J.,Clark, Michael P.,Boyd, Michael J.,Perola, Emanuele,Jones, Steven M.,Tsai, Alice,Jacobs, Marc D.,Bandarage, Upul K.,Ledeboer, Mark W.,Wang, Tiansheng,Deng, Hongbo,Ledford, Brian,Gu, Wenxin,Duffy, John P.,Bethiel, Randy S.,Shannon, Dean,Byrn, Randal A.,Leeman, Joshua R.,Rijnbrand, Rene,Bennett, Hamilton B.,O’Brien, Colleen,Memmott, Christine,Nti-Addae, Kwame,Bennani, Youssef L.,Charifson, Paul S.. "Discovery of Novel, Orally Bioavailable β-Amino Acid Azaindole Inhibitors of Influenza PB2". supporting information. p. 256 - 260. Retrieved 2017/03/08.