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Home Aldehydes 2420-16-8
2420-16-8,MFCD00104599
Catalog No.:AA003J5F

2420-16-8 | 3-Chloro-4-hydroxybenzaldehyde

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
97%
in stock  
$9.00   $7.00
- +
10g
97%
in stock  
$13.00   $9.00
- +
25g
97%
in stock  
$23.00   $16.00
- +
100g
97%
in stock  
$89.00   $62.00
- +
500g
97%
in stock  
$440.00   $308.00
- +
  • 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:
AA003J5F
Chemical Name:
3-Chloro-4-hydroxybenzaldehyde
CAS Number:
2420-16-8
Molecular Formula:
C7H5ClO2
Molecular Weight:
156.5664
MDL Number:
MFCD00104599
SMILES:
O=Cc1ccc(c(c1)Cl)O
NSC Number:
85482
Properties
Properties
 
BP:
251.1°C at 760 mmHg  
Form:
Solid  
MP:
145-147 °C(lit.)  
Refractive Index:
1.5812 (estimate)  
Stability:
Air Sensitive  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
127  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
1.9  

Upstream Synthesis Route

[1]TetrahedronLetters,1994,vol.35,#28,p.5043-5046

[2]Patent:WO2010/127212,2010,A1,.Locationinpatent:Page/Pagecolumn35

[3]Patent:WO2010/127208,2010,A1,.Locationinpatent:Page/Pagecolumn55

[4]TetrahedronAsymmetry,1997,vol.8,#24,p.4003-4006

[5]SyntheticCommunications,2012,vol.42,#24,p.3655-3663,9

[6]Patent:WO2009/158393,2009,A1,.Locationinpatent:Page/Pagecolumn113

[7]Synthesis,2002,#17,p.2503-2512

[8]Patent:US2003/125356,2003,A1,

[9]AsianJournalofChemistry,2018,vol.30,#1,p.167-170

[10]BioorganicandMedicinalChemistryLetters,2011,vol.21,#2,p.769-772

[11]Patent:CN104341347,2018,B,.Locationinpatent:Paragraph0138;0139

[12]ChemischeBerichte,1904,vol.37,p.4033

[13]JournalofOrganicChemistry,1953,vol.18,p.121,124

[14]JournaloftheChemicalSociety,1965,p.954-973

[15]OrganicandBiomolecularChemistry,2005,vol.3,#7,p.1233-1239

[16]Patent:US6582351,2003,B1,

[17]GreenChemistry,2012,vol.14,#6,p.1673-1679

[18]Chemistry-AEuropeanJournal,2018,vol.24,#43,p.11119-11130

[1]GreenChemistry,2014,vol.16,#5,p.2807-2814

[1]ResearchonChemicalIntermediates,2015,vol.41,#11,p.8147-8158

[1]JournalofMedicinalChemistry,1998,vol.41,#19,p.3572-3581

[2]JournalfuerPraktischeChemie(Leipzig),1941,vol.<2>158,p.245,250

[1]Patent:US2003/125356,2003,A1,

Downstream Synthesis Route

[1]Fadnavis;Vadivel,S.Kumara;Sharfuddin;Bhalerao[TetrahedronAsymmetry,1997,vol.8,#24,p.4003-4006]

[2]CurrentPatentAssignee:VERTEXPHARMACEUTICALS(OLD)-US2008/9524,2008,A1Locationinpatent:Page/Pagecolumn382-383;383

[3]CurrentPatentAssignee:VERTEXPHARMACEUTICALS(OLD)-US2011/98311,2011,A1

[4]CurrentPatentAssignee:VERTEXPHARMACEUTICALS(OLD)-US2015/231142,2015,A1Locationinpatent:Paragraph1119

[5]RamaRao;Chakraborty;LaxmaReddy;SrinivasaRao[TetrahedronLetters,1994,vol.35,#28,p.5043-5046]

[6]Woo,L.W.Lawrence;Bubert,Christian;Sutcliffe,Oliver-B.;Smith,Andrew;Chander,SurinderK.;Mahon,MaryF.;Purohit,Atul;Reed,MichaelJ.;Potter,BarryV.L.[JournalofMedicinalChemistry,2007,vol.50,#15,p.3540-3560]

[7]Dawson,MarciaI.;Xia,Zebin;Liu,Gang;Fontana,JosephA.;Farhana,Lulu;Patel,BhamikB.;Arumugarajah,Sankari;Bhuiyan,Mohammad;Zhang,Xiao-Kun;Han,Young-Hoon;Stallcup,WilliamB.;Fukushi,Jun-Ichi;Mustelin,Tomas;Tautz,Lutz;Su,Ying;Harris,DanniL.;Waleh,Nahid;Hobbs,PeterD.;Jong,Ling;Chao,Wan-Ru;Schiff,LeonardJ.;Sani,BrahmaP.[JournalofMedicinalChemistry,2007,vol.50,#11,p.2622-2639]

[8]Machin,PeterJ.;Hurst,DavidN.;Bradshaw,RachelM.;Blaber,LeslieC.;Burden,DavidT.;etal.[JournalofMedicinalChemistry,1983,vol.26,#11,p.1570-1576]

[9]CurrentPatentAssignee:AMERICANT3BIOLOGICALSCIENCETECH;T4BIOSCIENCE;CHANGZHOUUNIVERSITY-CN105440020,2016,ALocationinpatent:Paragraph0090;0091

[10]CurrentPatentAssignee:ITHERXPHARMACEUTICALS,INC.-WO2006/78754,2006,A1Locationinpatent:Page/Pagecolumn47-48

[11]Dawson,MarciaI.;Xia,Zebin;Jiang,Tao;Ye,Mao;Fontana,JosephA.;Farhana,Lulu;Patel,Bhaumik;Li,PingXue;Bhuiyan,Mohammad;Pellicciari,Roberto;Macchiarulo,Antonio;Nuti,Roberto;Zhang,Xiao-Kun;Han,Young-Hoon;Tautz,Lutz;Hobbs,PeterD.;Jong,Ling;Waleh,Nahid;Chao,Wan-Ru;Feng,Gen-Sheng;Pang,Yuhong;Su,Ying[JournalofMedicinalChemistry,2008,vol.51,#18,p.5650-5662]

[12]CurrentPatentAssignee:SUMITOMOCHEMICALCOMPANYLIMITED;SumitomoChemical(w/oDongwooFine-Chem)-JP2005/314352,2005,ALocationinpatent:Page/Pagecolumn50

[13]Inada,Haruki;Shibuya,Masatoshi;Yamamoto,Yoshihiko[JournalofOrganicChemistry,2020,vol.85,#17,p.11047-11059]

[14]CurrentPatentAssignee:UNIVERSITYOFLONDON-WO2022/58733,2022,A1Locationinpatent:Page/Pagecolumn42;108

[15]CurrentPatentAssignee:UNIVERSITYOFLONDON-WO2022/58733,2022,A1Locationinpatent:Page/Pagecolumn42;108

[1]Synthesis,2002,p.2503-2512

[2]JournaloftheChemicalSociety,1965,p.954-973

105960-29-0    127-68-4   
aqueousNaOH 
  2420-16-8 

[1]JournalfurpraktischeChemie(Leipzig1954),1941,vol.<2>158,p.245,250

[1]JournalofMedicinalChemistry,2000,vol.43,p.690-705

[1]BioorganicandMedicinalChemistry,2017,vol.25,p.3471-3482

[2]JournalofMedicinalChemistry,2008,vol.51,p.5650-5662

[3]EuropeanJournalofMedicinalChemistry,2009,vol.44,p.2434-2446

[4]JournalofMedicinalChemistry,2007,vol.50,p.2622-2639

[5]JournalofOrganicChemistry,2019,vol.84,p.11799-11812

[6]BioorganicandMedicinalChemistry,2004,vol.12,p.2553-2570

Literature

Title: 2-Chloro-4-{(E)-[(4-chloro-phen-yl)imino]-meth-yl}phenol.

Journal: Acta crystallographica. Section E, Structure reports online 20120301

Title: Hydrogen bond, dimerization and vibrational modes in 2-chloro-3-hydroxybenzaldehyde and 3-chloro-4-hydroxybenzaldehyde from vibrational and ab initio studies.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20101201

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