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3006-96-0

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3006-96-0 Usage

Chemical Properties

Off-white solid

Uses

Different sources of media describe the Uses of 3006-96-0 differently. You can refer to the following data:
1. 4-(Hydroxymethyl)benzoic Acid is an intermediate in the synthesis of Eprosartan (E590100), a prototype of the imidazoleacrylic acid angiotensin II receptor antagonists used as an antihypertensive age nt.
2. This linkage reagent for SPPS is essentially acid stable. It is useful in combination with Fmoc-amino acids. Its peptide esters are usually cleaved by basic or nucleophilic reagents, especially by ammonia in the preparation of peptide amides.
3. 4-(Hydroxymethyl)benzoic Acid (Eprosartan USP Related Compound E) is an intermediate in the synthesis of Eprosartan (E590100), a prototype of the imidazoleacrylic acid angiotensin II receptor antagonists used as an antihypertensive agent.

Synthesis Reference(s)

Journal of the American Chemical Society, 107, p. 1365, 1985 DOI: 10.1021/ja00291a042

Check Digit Verification of cas no

The CAS Registry Mumber 3006-96-0 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 3,0,0 and 6 respectively; the second part has 2 digits, 9 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 3006-96:
(6*3)+(5*0)+(4*0)+(3*6)+(2*9)+(1*6)=60
60 % 10 = 0
So 3006-96-0 is a valid CAS Registry Number.
InChI:InChI=1/C8H8O3/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4,9H,5H2,(H,10,11)

3006-96-0 Well-known Company Product Price

  • Brand
  • (Code)Product description
  • CAS number
  • Packaging
  • Price
  • Detail
  • TCI America

  • (H0769)  4-Hydroxymethylbenzoic Acid  >98.0%(T)

  • 3006-96-0

  • 10g

  • 1,190.00CNY

  • Detail
  • TCI America

  • (H0769)  4-Hydroxymethylbenzoic Acid  >98.0%(T)

  • 3006-96-0

  • 25g

  • 2,290.00CNY

  • Detail
  • Alfa Aesar

  • (B22183)  4-(Hydroxymethyl)benzoic acid, 98+%   

  • 3006-96-0

  • 1g

  • 438.0CNY

  • Detail
  • Alfa Aesar

  • (B22183)  4-(Hydroxymethyl)benzoic acid, 98+%   

  • 3006-96-0

  • 5g

  • 1437.0CNY

  • Detail
  • Alfa Aesar

  • (B22183)  4-(Hydroxymethyl)benzoic acid, 98+%   

  • 3006-96-0

  • 25g

  • 3436.0CNY

  • Detail
  • USP

  • (1238262)  EprosartanRelatedCompoundE  United States Pharmacopeia (USP) Reference Standard

  • 3006-96-0

  • 1238262-15MG

  • 13,501.80CNY

  • Detail
  • Aldrich

  • (382639)  4-(Hydroxymethyl)benzoicacid  99%

  • 3006-96-0

  • 382639-1G

  • 457.47CNY

  • Detail
  • Aldrich

  • (382639)  4-(Hydroxymethyl)benzoicacid  99%

  • 3006-96-0

  • 382639-10G

  • CNY

  • Detail

3006-96-0SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 11, 2017

Revision Date: Aug 11, 2017

1.Identification

1.1 GHS Product identifier

Product name 4-(Hydroxymethyl)benzoic acid

1.2 Other means of identification

Product number -
Other names hb linker

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:3006-96-0 SDS

3006-96-0Relevant articles and documents

One-step highly selective oxidation of p-xylene to 4-hydroxymethylbenzoic acid over Cu-MOF catalysts under mild conditions

Li, Ying,Wu, Mingzhu,Chen, Daomei,Jiang,He, Jiao,Luo,Wang, Wei,Wang, Jiaqiang

, (2019)

p-Xylene, a cheap industrial raw material, is mainly used to synthesize terephthalic acid. However, p-xylene was oxidized rarely to other oxygen-containing derivatives. On the other hand, current methods for synthesis of 4-hydroxymethylenzoic acid suffer from multistep reactions, long reaction time, high temperature, high pressure, and lower selectivity. In this work, p-xylene was directly oxidized into 4-hydroxymethylbenzoic acid using Cu-MOF as the catalyst, acetonitrile as the solvent, and 30% H2O2 as the oxidant under mild conditions. Very high selectivity (99.2%) of 4-hydroxymethylbenzoic acid and good substrate conversion (85.5%) of p-xylene were achieved at 30 °C for 5 h. Fast hot catalyst filtration experiments proved that Cu-MOF acted as a heterogeneous catalyst. It can be reused three times without losing its activity. Under optimized conditions, the selectivity of 4-hydroxymethyl benzoic acid and the conversion of p-xylene were 97.6% and 84.8% even though the experiment was amplified 15-folds. The efficiency of H2O2 was also up to 92.0%. The reaction mechanism was proposed combined with the analysis of XRD, FT-IR and XPS. All data displayed that Cu-MOF shows great potential as a catalyst for highly selective oxidation of stable C–H to high value-added compounds containing two diverse C–O bands under mild conditions. It also opens a new way to use of p-xylene.

Gram-scale synthesis of carboxylic acids via catalytic acceptorless dehydrogenative coupling of alcohols and hydroxides at an ultralow Ru loading

Chen, Cheng,Cheng, Hua,Verpoort, Francis,Wang, Zhi-Qin,Wu, Zhe,Yuan, Ye,Zheng, Zhong-Hui

, (2021/12/13)

Acceptorless dehydrogenative coupling (ADC) of alcohols and water/hydroxides is an emergent and graceful approach to produce carboxylic acids. Therefore, it is of high demand to develop active and practical catalysts/catalytic systems for this attractive transformation. Herein, we designed and fabricated a series of cyclometallated N-heterocyclic carbene-Ru (NHC-Ru) complexes via ligand tuning of [Ru-1], the superior complex in our previous work. Gratifyingly, gram-scale synthesis of carboxylic acids was efficiently enabled at an ultralow Ru loading (62.5 ppm) in open air. Moreover, effects of distinct ancillary NHC ligands and other parameters on this catalytic process were thoroughly studied, while further systematic studies were carried out to provide rationales for the activity trend of [Ru-1]-[Ru-7]. Finally, determination of quantitative green metrics illustrated that the present work exhibited superiority over representative literature reports. Hopefully, this study could provide valuable input for researchers who are engaging in metal-catalyzed ADC reactions.

Direct Heterogenization of the Ru-Macho Catalyst for the Chemoselective Hydrogenation of α,β-Unsaturated Carbonyl Compounds

Padmanaban, Sudakar,Gunasekar, Gunniya Hariyanandam,Yoon, Sungho

supporting information, p. 6881 - 6888 (2021/03/01)

In this study, a commercially available homogeneous pincer-type complex, Ru-Macho, was directly heterogenized via the Lewis acid-catalyzed Friedel-Crafts reaction using dichloromethane as the cross-linker to obtain a heterogeneous, pincer-type Ru porous organometallic polymer (Ru-Macho-POMP) with a high surface area. Notably, Ru-Macho-POMP was demonstrated to be an efficient heterogeneous catalyst for the chemoselective hydrogenation of α,β-unsaturated carbonyl compounds to their corresponding allylic alcohols using cinnamaldehyde as a model compound. The Ru-Macho-POMP catalyst showed a high turnover frequency (TOF = 920 h-1) and a high turnover number (TON = 2750), with high chemoselectivity (99%) and recyclability during the selective hydrogenation of α,β-unsaturated carbonyl compounds.

Synthesis, in vitro and in silico anticancer activity of new 4-methylbenzamide derivatives containing 2,6-substituted purines as potential protein kinases inhibitors

Bozhok, Tatyana,Faryna, Aliaksandr,Kalinichenko, Elena,Panibrat, Alesya

, (2021/11/30)

A novel class of potential protein kinase inhibitors 7–16 was synthesized in high yields using various substituted purines. The most promising compounds, 7 and 10, exhibited inhibitory activity against seven cancer cell lines. The IC50 values f

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