4-(Pyridin-3-ylmethoxy)benzoic acid

Base Information

• Chemical Name: 4-(Pyridin-3-ylmethoxy)benzoic acid
• CAS No.: 898138-45-9
• Molecular Formula: C13H11NO3
• Molecular Weight: 229.23
• DSSTox Substance ID: DTXSID00585524
• Nikkaji Number: J2.625.822G
• Wikidata: Q82477502
• Mol file: 898138-45-9.mol

Synonyms:4-(pyridin-3-ylmethoxy)benzoic acid;898138-45-9;4-[(Pyridin-3-yl)methoxy]benzoic acid;4-(Pyridin-3-ylmethoxy)benzoicacid;SCHEMBL18906035;DTXSID00585524;YKB13845;MFCD08098736;AKOS000103436;BS-33062;CS-0212868;EN300-31577;4-(pyridin-3-ylmethoxy)benzoic acid, AldrichCPR;A861051;F2158-0591;Z228589272

Chemical Property of 4-(Pyridin-3-ylmethoxy)benzoic acid

Chemical Property:

• PSA: 59.42000
• LogP: 2.35880
• Storage Temp.: 2-8°C
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 229.07389321
• Heavy Atom Count: 17
• Complexity: 249

Purity/Quality:

97% ^*data from raw suppliers

4-(Pyridin-3-ylmethoxy)benzoicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CN=C1)COC2=CC=C(C=C2)C(=O)O