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3964-58-7,MFCD00002549
Catalog No.:AA00780D

3964-58-7 | 3-Chloro-4-hydroxybenzoic acid

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1g
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$7.00   $5.00
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5g
95%
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$13.00   $9.00
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10g
95%
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$18.00   $13.00
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25g
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$40.00   $28.00
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100g
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$131.00   $92.00
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  • 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:
AA00780D
Chemical Name:
3-Chloro-4-hydroxybenzoic acid
CAS Number:
3964-58-7
Molecular Formula:
C7H5ClO3
Molecular Weight:
172.5658
MDL Number:
MFCD00002549
SMILES:
OC(=O)c1ccc(c(c1)Cl)O
NSC Number:
21186
Properties
Computed Properties
 
Complexity:
160  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
2  

Upstream Synthesis Route

[1]JournalofMedicinalChemistry,1987,vol.30,#10,p.1887-1891

[1]JournaloftheChemicalSociety,PerkinTransactions2:PhysicalOrganicChemistry(1972-1999),1984,#6,p.985-988

[2]JournaloftheChemicalSociety,PerkinTransactions2:PhysicalOrganicChemistry(1972-1999),1984,#6,p.985-988

[1]JournalfuerPraktischeChemie(Leipzig),1876,vol.<2>13,p.427

[1]JournalfuerPraktischeChemie(Leipzig),1876,vol.<2>13,p.427

[1]BulletindelaSocieteChimiquedeFrance,1927,vol.<4>41,p.1363

Downstream Synthesis Route

[1]JournalofMedicinalChemistry,1987,vol.30,p.1887-1891

[2]Patent:WO2012/125613,2012,A1.Locationinpatent:Page/Pagecolumn145

[3]IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,2015,vol.54B,p.902-907

[4]ChemischeBerichte,1897,vol.30,p.1477

[5]Patent:US2009/298894,2009,A1.Locationinpatent:Page/Pagecolumn63

[6]Patent:WO2009/126535,2009,A1.Locationinpatent:Page/Pagecolumn54

[1]EuropeanJournalofMedicinalChemistry,2013,vol.65,p.360-375

[2]JournaloftheScienceofFoodandAgriculture,1967,vol.18,p.368,369

[3]NewJournalofChemistry,2016,vol.40,p.6977-6985

[1]JournalfurpraktischeChemie(Leipzig1954),1876,vol.<2>13,p.427

[1]JournalofMedicinalChemistry,1997,vol.40,p.1075-1089

[2]AnnalidiChimica,1955,vol.45,p.205,213

[3]JournalofChemicalResearch,Miniprint,1992,p.201-226

[4]Patent:JP5962949,2016,B2.Locationinpatent:Paragraph0142;0143

[1]JournaloftheChemicalSociety,1954,p.2556,2557,2561

Literature

Title: Genome sequence of Desulfitobacterium hafniense DCB-2, a Gram-positive anaerobe capable of dehalogenation and metal reduction.

Journal: BMC microbiology 20120101

Title: Preparation and Characterization of a Polyclonal Antibody against Brominated Protein.

Journal: Journal of clinical biochemistry and nutrition 20090101

Title: Occurrence of several genes encoding putative reductive dehalogenases in Desulfitobacterium hafniense/frappieri and Dehalococcoides ethenogenes.

Journal: Canadian journal of microbiology 20020801

Title: Characterization of the B12- and iron-sulfur-containing reductive dehalogenase from Desulfitobacterium chlororespirans.

Journal: The Journal of biological chemistry 20011102

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SDS
Tags:3964-58-7 Molecular Formula|3964-58-7 MDL|3964-58-7 SMILES|3964-58-7 3-Chloro-4-hydroxybenzoic acid