2-(3,4-Dihydroxyphenyl)-2-hydroxypropanoic acid

Base Information

• Chemical Name: 2-(3,4-Dihydroxyphenyl)-2-hydroxypropanoic acid
• CAS No.: 22681-72-7
• Molecular Formula: C9H10O5
• Molecular Weight: 198.175
• Hs Code.: 2942000000
• DSSTox Substance ID: DTXSID00945346
• Mol file: 22681-72-7.mol

Synonyms:alpha-(3,4-dihydroxyphenyl)lactic acid;alpha-DHPLA

Chemical Property of 2-(3,4-Dihydroxyphenyl)-2-hydroxypropanoic acid

Chemical Property:

• Vapor Pressure: 4.91E-10mmHg at 25°C
• Refractive Index: 1.649
• Boiling Point: 480.3 °C at 760 mmHg
• PKA: 3.53±0.25(Predicted)
• Flash Point: 258.4 °C
• PSA: 97.99000
• Density: 1.54 g/cm³
• LogP: 0.38990
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 198.05282342
• Heavy Atom Count: 14
• Complexity: 229

Purity/Quality:

99%+, ^*data from raw suppliers

Danshensu 98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C1=CC(=C(C=C1)O)O)(C(=O)O)O
• Uses: α-(3,4-Dihydroxyphenyl)lactic Acid is an anti-inflammatory agent that consists of glucocorticoid and Savia miltiorrrhiza extract that can be used toward protecting bones.