1-(Phenylthio)cyclohexanecarboxylic acid 2-morpholinoethyl ester oxalate

Base Information

• Chemical Name: 1-(Phenylthio)cyclohexanecarboxylic acid 2-morpholinoethyl ester oxalate
• CAS No.: 101329-97-9
• Molecular Formula: C21H29NO7S
• Molecular Weight: 439.5225
• DSSTox Substance ID: DTXSID70143852

Synonyms:1-(Phenylthio)cyclohexanecarboxylic acid 2-morpholinoethyl ester oxalate;101329-97-9;Cyclohexanecarboxylic acid, 1-(phenylthio)-, 2-morpholinoethyl ester, ethanedioate (1:1);DTXSID70143852;C19H27NO3S.C2H2O4;LS-56747;C19-H27-N-O3-S.C2-H2-O4

Chemical Property of 1-(Phenylthio)cyclohexanecarboxylic acid 2-morpholinoethyl ester oxalate

Chemical Property:

• Vapor Pressure: 1.48E-09mmHg at 25°C
• Boiling Point: 484.9°Cat760mmHg
• Flash Point: 247.1°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 8
• Exact Mass: 439.16647344
• Heavy Atom Count: 30
• Complexity: 458

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)(C(=O)OCCN2CCOCC2)SC3=CC=CC=C3.C(=O)(C(=O)O)O

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