2-[(4-Chlorobenzyl)thio]propanoic acid

Base Information

• Chemical Name: 2-[(4-Chlorobenzyl)thio]propanoic acid
• CAS No.: 122305-66-2
• Molecular Formula: C10H11ClO2S
• Molecular Weight: 230.71
• Hs Code.: 2930909090
• DSSTox Substance ID: DTXSID90399859
• Mol file: 122305-66-2.mol

Synonyms:2-[(4-CHLOROBENZYL)THIO]PROPANOIC ACID;122305-66-2;2-[(4-chlorophenyl)methylsulfanyl]propanoic Acid;2-((4-Chlorobenzyl)thio)propanoic acid;2-{[(4-CHLOROPHENYL)METHYL]SULFANYL}PROPANOIC ACID;DTXSID90399859;MFCD04070622;AKOS000173007;AKOS017258702;2-((4-Chlorobenzyl)thio)propanoicacid;LS-08943;CS-0329257

Chemical Property of 2-[(4-Chlorobenzyl)thio]propanoic acid

Chemical Property:

• Vapor Pressure: 8.18E-06mmHg at 25°C
• Boiling Point: 360.1°C at 760 mmHg
• Flash Point: 171.6°C
• PSA: 62.60000
• Density: 1.309g/cm³
• LogP: 3.04630
• XLogP3: 3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 230.0168285
• Heavy Atom Count: 14
• Complexity: 191

Purity/Quality:

99% ^*data from raw suppliers

2-[(4-Chlorobenzyl)thio]propanoicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C(=O)O)SCC1=CC=C(C=C1)Cl