1,3-Dihydroxypentane-1,3,5-tricarboxylic acid

Base Information

• Chemical Name: 1,3-Dihydroxypentane-1,3,5-tricarboxylic acid
• CAS No.: 3563-60-8
• Molecular Formula: C8H12 O8
• Molecular Weight: 0
• Hs Code.: 2918199090
• DSSTox Substance ID: DTXSID20434949
• Nikkaji Number: J12.999B
• Wikidata: Q82249565
• Mol file: 3563-60-8.mol

Synonyms:3563-60-8;Phorbic acid;DTXSID20434949;2-C-(2-Carboxyethyl)-3-deoxypentaric acid

Chemical Property of 1,3-Dihydroxypentane-1,3,5-tricarboxylic acid

Chemical Property:

• PSA: 152.36000
• LogP: -1.49750
• XLogP3: -1.8
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 7
• Exact Mass: 236.05321734
• Heavy Atom Count: 16
• Complexity: 298

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

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