5-(4-Hydroxymethyl-3-methoxyphenoxy)valeric acid

Base Information

• Chemical Name: 5-(4-Hydroxymethyl-3-methoxyphenoxy)valeric acid
• CAS No.: 213024-57-8
• Molecular Formula: C13H18O5
• Molecular Weight: 254.28
• DSSTox Substance ID: DTXSID30403368
• Wikidata: Q82207019
• Mol file: 213024-57-8.mol

Synonyms:5-(4-Hydroxymethyl-3-methoxyphenoxy)valeric acid;213024-57-8;5-[4-(hydroxymethyl)-3-methoxyphenoxy]pentanoic acid;5-(4-(Hydroxymethyl)-3-methoxyphenoxy)pentanoic acid;SCHEMBL1229002;5-[4-(hydroxymethyl)-3-methoxy-phenoxy]pentanoic Acid;DTXSID30403368;AKOS024307504;FT-0643965;5-(4-Hydroxymethyl-3-Methoxyphenoxy)ValericAcid;A815258;J-013977

Chemical Property of 5-(4-Hydroxymethyl-3-methoxyphenoxy)valeric acid

Chemical Property:

• Vapor Pressure: 1.8E-09mmHg at 25°C
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 8
• Exact Mass: 254.11542367
• Heavy Atom Count: 18
• Complexity: 244

Purity/Quality:

98%min ^*data from raw suppliers

5-(4-HYDROXYMETHYL-3-METHOXYPHENOXY)VALERIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

• Safety Statements: 22-24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=CC(=C1)OCCCCC(=O)O)CO