(S)-(4-Cyanophenyl) 4-(2-methylbutoxy)thiobenzoate

Base Information

• Chemical Name: (S)-(4-Cyanophenyl) 4-(2-methylbutoxy)thiobenzoate
• CAS No.: 64240-66-0
• Molecular Formula: C19H19 N O2 S
• Molecular Weight: 325.42466
• European Community (EC) Number: 264-748-1
• DSSTox Substance ID: DTXSID90886673
• Nikkaji Number: J310.083I
• Mol file: 64240-66-0.mol

Synonyms:S-(4-Cyanophenyl) 4-(2-methylbutoxy)thiobenzoate;64240-66-0;(S)-(4-Cyanophenyl) 4-(2-methylbutoxy)thiobenzoate;Benzenecarbothioic acid, 4-(2-methylbutoxy)-, S-(4-cyanophenyl) ester;EINECS 264-748-1;C19H19NO2S;SCHEMBL11139226;DTXSID90886673;C19-H19-N-O2-S;4-(2-Methylbutoxy)benzenecarbothioic acid S-(4-cyanophenyl) ester

Chemical Property of (S)-(4-Cyanophenyl) 4-(2-methylbutoxy)thiobenzoate

Chemical Property:

• Vapor Pressure: 3.33E-09mmHg at 25°C
• Boiling Point: 475.4°C at 760 mmHg
• Flash Point: 241.3°C
• PSA: 75.39000
• Density: 1.18g/cm³
• LogP: 4.91568
• XLogP3: 5.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 325.11365002
• Heavy Atom Count: 23
• Complexity: 414

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C)COC1=CC=C(C=C1)C(=O)SC2=CC=C(C=C2)C#N