3,3,4,4,4-pentachlorobutanoic Acid

Base Information

• Chemical Name: 3,3,4,4,4-pentachlorobutanoic Acid
• CAS No.: 90996-11-5
• Molecular Formula: C4H3Cl5O2
• DSSTox Substance ID: DTXSID20400689
• Wikidata: Q82203705
• Mol file: 90996-11-5.mol

Synonyms:3,3,4,4,4-pentachlorobutanoic Acid;3,3,4,4,4-PENTACHLORO-BUTYRIC ACID;90996-11-5;Butanoic acid, 3,3,4,4,4-pentachloro-;DTXSID20400689;AKOS024331690

Chemical Property of 3,3,4,4,4-pentachlorobutanoic Acid

Chemical Property:

• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 259.854618
• Heavy Atom Count: 11
• Complexity: 160

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C(=O)O)C(C(Cl)(Cl)Cl)(Cl)Cl