(R)-(+)-4-Methyl-4-(trichloromethyl)-2-oxetanone

Base Information

• Chemical Name: (R)-(+)-4-Methyl-4-(trichloromethyl)-2-oxetanone
• CAS No.: 93239-42-0
• Molecular Formula: C5H5 Cl3 O2
• Molecular Weight: 203.452
• Hs Code.: 2932209090
• European Community (EC) Number: 625-428-0
• DSSTox Substance ID: DTXSID80416064
• Nikkaji Number: J1.381.126A
• Wikidata: Q76303673
• Mol file: 93239-42-0.mol

Synonyms:93239-42-0;(R)-(+)-4-Methyl-4-(trichloromethyl)-2-oxetanone;(4R)-4-methyl-4-(trichloromethyl)oxetan-2-one;(R)-4-methyl-4-(trichloromethyl)oxetan-2-one;SCHEMBL9574920;DTXSID80416064;MFCD00060124;AKOS017343743;AT19325;(R)-4-methyl-4-(trichloromethyl)-2-oxetanone;(R)-4alpha-(Trichloromethyl)-4-methyloxetane-2-one;(R)-(+)-4-Methyl-4-(trichloromethyl)-2-oxetanone, 98%;(R)-(+)-3-HYDROXY-3-METHYL-4,4,4-TRICHLOROBUTYRICBETA-LACTONE;inverted exclamation mark(2)R inverted exclamation mark(3)-(+)-4-Methyl-4-(trichloromethyl)-2-oxetanone

Chemical Property of (R)-(+)-4-Methyl-4-(trichloromethyl)-2-oxetanone

Chemical Property:

• Vapor Pressure: 0.0808mmHg at 25°C
• Melting Point: 43-44 °C(lit.)
• Refractive Index: 1.522
• Boiling Point: 120 °C0.1 mm Hg(lit.)
• Flash Point: 97.3°C
• PSA: 26.30000
• Density: 1.591g/cm³
• LogP: 2.06220
• Storage Temp.: 2-8°C
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 201.935512
• Heavy Atom Count: 10
• Complexity: 174

Purity/Quality:

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

(R)-(+)-4-Methyl-4-(trichloromethyl)-2-oxetanone 98% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 20/21/22-36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(CC(=O)O1)C(Cl)(Cl)Cl
• Isomeric SMILES: C[C@@]1(CC(=O)O1)C(Cl)(Cl)Cl
• Uses: (4R)-4-Methyl-4-(trichloromethyl)-2-oxetanone can be used as LPA1 receptor antagonists to treat fibrosis. (R)-(+)-4-Methyl-4-(trichloromethyl)-2-oxetanone may be used in the preparation of (S)-citramalic acid.