Ethyl ((2-(4-methyl-5-oxo-3-cyclohexen-1-yl)propyl)thio)acetate

Base Information

• Chemical Name: Ethyl ((2-(4-methyl-5-oxo-3-cyclohexen-1-yl)propyl)thio)acetate
• CAS No.: 84083-20-5
• Molecular Formula: C14H22 O3 S
• Molecular Weight: 270.38768
• European Community (EC) Number: 282-069-9
• DSSTox Substance ID: DTXSID001004366
• Nikkaji Number: J297.481I
• Mol file: 84083-20-5.mol

Synonyms:84083-20-5;EINECS 282-069-9;Ethyl ((2-(4-methyl-5-oxo-3-cyclohexen-1-yl)propyl)thio)acetate;Ethyl [[2-(4-methyl-5-oxo-3-cyclohexen-1-yl)propyl]thio]acetate;DTXSID001004366;Ethyl {[2-(4-methyl-5-oxocyclohex-3-en-1-yl)propyl]sulfanyl}acetate;2-[[2-(4-Methyl-5-oxo-3-cyclohexen-1-yl)propyl]thio]acetic acid ethyl ester

Chemical Property of Ethyl ((2-(4-methyl-5-oxo-3-cyclohexen-1-yl)propyl)thio)acetate

Chemical Property:

• Vapor Pressure: 5.11E-06mmHg at 25°C
• Boiling Point: 381.3°C at 760 mmHg
• Flash Point: 176.9°C
• PSA: 68.67000
• Density: 1.082g/cm³
• LogP: 2.84420
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 270.12896573
• Heavy Atom Count: 18
• Complexity: 336

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)CSCC(C)C1CC=C(C(=O)C1)C

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