S-ethyl 4-ethylsulfonylbenzenecarbothioate

Base Information

• Chemical Name: S-ethyl 4-ethylsulfonylbenzenecarbothioate
• CAS No.: 7152-44-5
• Molecular Formula: C11H14 O3 S2
• Molecular Weight: 258.36
• NSC Number: 23808
• DSSTox Substance ID: DTXSID90992001
• Wikidata: Q82982005
• Mol file: 7152-44-5.mol

Synonyms:7152-44-5;S-ethyl 4-ethylsulfonylbenzenecarbothioate;NSC23808;DTXSID90992001;NSC-23808;Ethyl p-(ethyl sulfonyl) thiobenzoate;S-Ethyl 4-(ethanesulfonyl)benzene-1-carbothioate

Chemical Property of S-ethyl 4-ethylsulfonylbenzenecarbothioate

Chemical Property:

• Vapor Pressure: 2.96E-07mmHg at 25°C
• Boiling Point: 419.8°C at 760 mmHg
• Flash Point: 207.7°C
• PSA: 84.89000
• Density: 1.231g/cm³
• LogP: 3.45430
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 258.03843665
• Heavy Atom Count: 16
• Complexity: 322

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCSC(=O)C1=CC=C(C=C1)S(=O)(=O)CC