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38628-51-2,MFCD00016560
Catalog No.:AA003JWH

38628-51-2 | 3-(4-Carboxyphenyl)propionic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$6.00   $4.00
- +
5g
98%
in stock  
$55.00   $39.00
- +
10g
98%
in stock  
$87.00   $61.00
- +
25g
98%
in stock  
$135.00   $95.00
- +
100g
98%
in stock  
$451.00   $316.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003JWH
Chemical Name:
3-(4-Carboxyphenyl)propionic acid
CAS Number:
38628-51-2
Molecular Formula:
C10H10O4
Molecular Weight:
194.1840
MDL Number:
MFCD00016560
SMILES:
OC(=O)CCc1ccc(cc1)C(=O)O
Properties
Properties
 
BP:
406.1°C at 760 mmHg  
Form:
Solid  
MP:
289-293 °C(lit.)  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
216  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
4  
XLogP3:
1  

Upstream Synthesis Route

[1]ChemischeBerichte,1889,vol.22,p.2279

[2]ChemischeBerichte,1890,vol.23,p.3086

[1]Chemistry-AEuropeanJournal,2012,vol.18,#28,p.8673-8680

[2]JournaloftheChemicalSociety,1928,p.2576

[1]ChemicalandPharmaceuticalBulletin,2013,vol.61,#8,p.846-852

[1]JournaloftheChemicalSociety,1928,p.2576

[2]ChemicalandPharmaceuticalBulletin,2013,vol.61,#8,p.846-852

[1]ChemischeBerichte,1900,vol.33,p.2626

Downstream Synthesis Route

[1]JustusLiebigsAnnalenderChemie,1928,vol.462,p.147

[1]ChemischeBerichte,1889,vol.22,p.2279    ChemischeBerichte,1890,vol.23,p.3086

[1]ChemischeBerichte,1900,vol.33,p.2626

[1]Chemistry-AEuropeanJournal,2012,vol.18,p.8673-8680

[2]JournaloftheChemicalSociety,1928,p.2576

[1]Patent:WO2005/87236,2005,A1.Locationinpatent:Page/Pagecolumn39

[2]Patent:US2010/249095,2010,A1.Locationinpatent:Page/Pagecolumn68-69

[3]Tetrahedron,1995,vol.51,p.203-216

[4]JournaloftheChemicalSociety,1956,p.4647,3652

[5]Patent:US2012/71461,2012,A1.Locationinpatent:Page/Pagecolumn60

[6]ChemicalCommunications,2019,vol.55,p.7017-7020

Literature

Title: Control of interpenetration and gas-sorption properties of metal-organic frameworks by a simple change in ligand design.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany) 20120709

Title: 4-Methyl-sulfanyl-6-(4-pyrid-yl)-1,3,5-triazin-2-amine.

Journal: Acta crystallographica. Section E, Structure reports online 20110501

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SDS
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