MedKoo Cat#: 130336 | Name: 4-(Hydroxymethyl)benzoic acid
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Description:

WARNING: This product is for research use only, not for human or veterinary use.

4-(Hydroxymethyl)benzoic acid functions as an intermediate in the synthesis of Eprosartan. Eprosartan has the potential to serve as an antihypertensive agent.

Chemical Structure

4-(Hydroxymethyl)benzoic acid
4-(Hydroxymethyl)benzoic acid
CAS# 3006-96-0

Theoretical Analysis

MedKoo Cat#: 130336

Name: 4-(Hydroxymethyl)benzoic acid

CAS#: 3006-96-0

Chemical Formula: C8H8O3

Exact Mass: 152.0473

Molecular Weight: 152.15

Elemental Analysis: C, 63.15; H, 5.30; O, 31.55

Price and Availability

Size Price Availability Quantity
5g USD 250.00 2 Weeks
10g USD 350.00 2 Weeks
25g USD 650.00 2 Weeks
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Related CAS #
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Synonym
4-(Hydroxymethyl)benzoic acid; p-(Hydroxymethyl)benzoic acid
IUPAC/Chemical Name
4-(hydroxymethyl)benzoic acid
InChi Key
WWYFPDXEIFBNKE-UHFFFAOYSA-N
InChi Code
InChI=1S/C8H8O3/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4,9H,5H2,(H,10,11)
SMILES Code
O=C(O)C1=CC=C(CO)C=C1
Appearance
To be determined
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
To be determined
Shelf Life
>2 years if stored properly
Drug Formulation
To be determined
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 152.15 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
1. Theoretical Study of 4-(Hydroxymethyl)benzoic Acid Synthesis from Ethylene and 5-(Hydroxymethyl)furoic Acid Catalyzed by Sn-BEA 2. Qiu J, Boskin D, Oleson D, Wu W, Anderson M. Plasmon-enhanced electrochemical oxidation of 4-(hydroxymethyl)benzoic acid. J Chem Phys. 2022 Aug 28;157(8):081101. doi: 10.1063/5.0106914. PMID: 36049998. 3. Pacheco JJ, Davis ME. Synthesis of terephthalic acid via Diels-Alder reactions with ethylene and oxidized variants of 5-hydroxymethylfurfural. Proc Natl Acad Sci U S A. 2014 Jun 10;111(23):8363-7. doi: 10.1073/pnas.1408345111. Epub 2014 May 27. PMID: 24912153; PMCID: PMC4060660. 4. Park KH, Ehrler J, Spoerri H, Kurth MJ. Preparation of a 990-member chemical compound library of hydantoin- and isoxazoline-containing heterocycles using multipin technology. J Comb Chem. 2001 Mar-Apr;3(2):171-6. doi: 10.1021/cc0000702. PMID: 11300857. 5. Abd-Elgaliel WR, Gallazzi F, Lever SZ. Total solid-phase synthesis of bombesin analogs with different functional groups at the C-terminus. J Pept Sci. 2007 Jul;13(7):487-92. doi: 10.1002/psc.878. PMID: 17559059. 6. Lin YH, Leung NH, Holt KB, Thompson AL, Wilton-Ely JD. Bimetallic complexes based on carboxylate and xanthate ligands: synthesis and electrochemical investigations. Dalton Trans. 2009 Oct 14;(38):7891-901. doi: 10.1039/b901822k. Epub 2009 May 15. PMID: 19771352.