Methyl 3-oxocyclobutanecarboxylate

Base Information

Chemical Name:Methyl 3-oxocyclobutanecarboxylate
CAS No.:695-95-4
Molecular Formula:C6H8 O3
Molecular Weight:128.128
Hs Code.:2918300090
European Community (EC) Number:813-718-1
DSSTox Substance ID:DTXSID00553889
Nikkaji Number:J583.069I
Wikidata:Q72494161
Mol file:695-95-4.mol

Synonyms:METHYL 3-OXOCYCLOBUTANECARBOXYLATE;695-95-4;methyl 3-oxocyclobutane-1-carboxylate;Methyl 3-oxo-cyclobutanecarboxylate;3-METHOXYCARBONYLCYCLOBUTANONE;MFCD00604222;C6H8O3;3-Oxocyclobutanecarboxylic acid methyl ester;Cyclobutanecarboxylic acid, 3-oxo-, methyl ester;CYCLOBUTANECARBOXYLIC ACID, 3-OXO-, METHYL ESTER;3-oxo-1-cyclobutanecarboxylic acid methyl ester;SCHEMBL872959;Methyl3-oxocyclobutanecarboxylate;DTXSID00553889;IHLHSAIBOSSHQV-UHFFFAOYSA-N;methyl 3-oxocyclobutane carboxylate;BCP17549;AKOS006228714;CS-W007372;PB32215;Methyl 3-oxocyclobutanecarboxylate, 97%;SY012186;TS-01679;AM20070620;A26795;EN300-104282;methyl 3-oxidanylidenecyclobutane-1-carboxylate;A836553;A1-00070;J-522207

Suppliers and Price of Methyl 3-oxocyclobutanecarboxylate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Usbiological
3-Oxocyclobutanecarboxylic Acid Methyl Ester
250mg
$ 460.00

TRC
3-OxocyclobutanecarboxylicAcidMethylEster
500mg
$ 290.00

SynQuest Laboratories
Methyl 3-oxocyclobutanecarboxylate 95%
25 g
$ 72.00

SynQuest Laboratories
Methyl 3-oxocyclobutanecarboxylate 95%
100 g
$ 192.00

Medical Isotopes, Inc.
3-OxocyclobutanecarboxylicAcidMethylEster
1 g
$ 995.00

Medical Isotopes, Inc.
3-OxocyclobutanecarboxylicAcidMethylEster
500 mg
$ 775.00

Medical Isotopes, Inc.
Methyl3-oxocyclobutanecarboxylate 95+%
1 g
$ 325.00

Matrix Scientific
Methyl 3-oxocyclobutanecarboxylate >95%
100g
$ 194.00

Matrix Scientific
Methyl 3-oxocyclobutanecarboxylate >95%
25g
$ 69.00

Matrix Scientific
Methyl 3-oxocyclobutanecarboxylate >95%
5g
$ 20.00

Total 88 raw suppliers

Chemical Property of Methyl 3-oxocyclobutanecarboxylate

Chemical Property:

Vapor Pressure:0.612mmHg at 25°C
Boiling Point:188oC at 760 mmHg
Flash Point:72.5oC
PSA：43.37000
Density:1.219g/cm3
LogP:0.13850
Storage Temp.:2-8°C
Water Solubility.:Slightly soluble in water.
XLogP3:-0.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:128.047344113
Heavy Atom Count:9
Complexity:142

Purity/Quality:

99% ^*data from raw suppliers

3-Oxocyclobutanecarboxylic Acid Methyl Ester ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)C1CC(=O)C1
Uses Methyl 3-oxocyclobutanecarboxylate can be used as an intermediate for the synthesis of various pharmaceutical compounds. It is used for the preparation of novel imidazobenzazepine derivatives as dual H1/5-HT2A antagonists for the treatment of sleep disorders.

Technology Process of Methyl 3-oxocyclobutanecarboxylate

There total 1 articles about Methyl 3-oxocyclobutanecarboxylate 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:

: 15760-35-7
3-methylenecyclobutanecarbonitrile

: 695-95-4
methyl 3-oxocyclobutanecarboxylate

Guidance literature:: Multi-step reaction with 3 steps

1: aq. KOH / methanol

2: diethyl ether

3: O₃, Py / CH₂Cl₂ / -80 °C

With pyridine; potassium hydroxide; ozone; In methanol; diethyl ether; dichloromethane;

Reference yield: 100.0%

: 695-95-4
methyl 3-oxocyclobutanecarboxylate

: (2,4-dichloro-3-((1-methyl-6-(trifluoromethyl)-1H-indol-2-yl)methyl)phenyl)(piperazin-1-yl)methanone

: methyl 3-(4-(2,4-dichloro-3-((1-methyl-6-(trifluoromethyl)-1H-indol-2-yl)methyl)benzoyl)piperazin-1-yl)cyclobutanecarboxylate

Guidance literature:: methyl 3-oxocyclobutanecarboxylate; (2,4-dichloro-3-((1-methyl-6-(trifluoromethyl)-1H-indol-2-yl)methyl)phenyl)(piperazin-1-yl)methanone; With acetic acid; In 1,2-dichloro-ethane; at 20 ℃; for 0.75h;

With sodium tris(acetoxy)borohydride; In 1,2-dichloro-ethane; at 20 ℃; for 2.5h;

Reference yield: 95.1%

: 31600-50-7
2-benzyloxyethoxy(trimethyl)silane

: 695-95-4
methyl 3-oxocyclobutanecarboxylate

: methyl 3-(2-benzyloxyethoxy)cyclobutanecarboxylate

Guidance literature:: 2-benzyloxyethoxy(trimethyl)silane; methyl 3-oxocyclobutanecarboxylate; With trimethylsilyl trifluoromethanesulfonate; In dichloromethane; at -78 ℃; for 1h;

With triethylsilane; In dichloromethane; at -78 - 20 ℃; for 1h;