2-Hydroxyethyl gallate

Base Information

• Chemical Name: 2-Hydroxyethyl gallate
• CAS No.: 68162-50-5
• Molecular Formula: C9H10 O6
• Molecular Weight: 214.1721
• European Community (EC) Number: 269-011-8
• DSSTox Substance ID: DTXSID40987664
• Nikkaji Number: J317.376C
• Wikidata: Q82975976
• Mol file: 68162-50-5.mol

Synonyms:2-Hydroxyethyl gallate;68162-50-5;2-hydroxyethyl 3,4,5-trihydroxybenzoate;EINECS 269-011-8;Benzoic acid,3,4,5-trihydroxy-, 2-hydroxyethyl ester;SCHEMBL1885404;DTXSID40987664;NNCBVVNCQYNPPB-UHFFFAOYSA-N;3,4,5-Trihydroxybenzoic acid 2-hydroxyethyl ester;3,4,5-Trihydroxybenzoic acid 2-hydroxy-ethyl ester

Chemical Property of 2-Hydroxyethyl gallate

Chemical Property:

• Vapor Pressure: 4.26E-12mmHg at 25°C
• Boiling Point: 530.8°C at 760 mmHg
• PKA: 7.79±0.25(Predicted)
• Flash Point: 218.4°C
• PSA: 107.22000
• Density: 1.567g/cm³
• LogP: -0.04750
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 214.04773803
• Heavy Atom Count: 15
• Complexity: 207

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C=C(C(=C1O)O)O)C(=O)OCCO