3-(4-Hydroxymethylphenoxy)propionic acid

Base Information

• Chemical Name: 3-(4-Hydroxymethylphenoxy)propionic acid
• CAS No.: 101366-61-4
• Molecular Formula: C10H12O4
• Molecular Weight: 196.2
• Hs Code.: 2918990090
• European Community (EC) Number: 625-651-3
• DSSTox Substance ID: DTXSID20352992
• Wikidata: Q82130434
• Mol file: 101366-61-4.mol

Synonyms:101366-61-4;3-(4-Hydroxymethylphenoxy)propionic acid;3-(4-(Hydroxymethyl)phenoxy)propanoic acid;3-[4-(hydroxymethyl)phenoxy]propanoic Acid;3-(4-Hydroxymethylphenoxy) propionic acid;3-[4-(hydroxymethyl)phenoxy]propionic acid;Propanoic acid,3-[4-(hydroxymethyl)phenoxy]-;Propanoic acid, 3-[4-(hydroxymethyl)phenoxy]-;SCHEMBL854425;DTXSID20352992;WPWKJUVXEMKOHS-UHFFFAOYSA-N;MFCD00137851;AKOS009157175;AT13194;3-(4-Hydroxymethylphenoxy)propanoic acid;WS-01142;3-(4-(Hydroxymethyl)phenoxy)propanoicacid;3-(4-hydroxymethylphen-oxy)-propionic acid;CS-0321558;FT-0694595;J-000375;3-(4-Hydroxymethylphenoxy)propionic acid, >=98.0% (HPLC)

Chemical Property of 3-(4-Hydroxymethylphenoxy)propionic acid

Chemical Property:

• Vapor Pressure: 5.39E-06mmHg at 25°C
• Melting Point: 148-152 °C
• Boiling Point: 365.8 °C at 760 mmHg
• PKA: 4.20±0.10(Predicted)
• Flash Point: 146.2 °C
• PSA: 66.76000
• Density: 1.266 g/cm³
• LogP: 1.03240
• Storage Temp.: Store at 0-5°C
• XLogP3: 0.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 196.07355886
• Heavy Atom Count: 14
• Complexity: 173

Purity/Quality:

98% ^*data from raw suppliers

3-(4-Hydroxymethylphenoxy)propionicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1CO)OCCC(=O)O