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58452-00-9,MFCD00016526
Catalog No.:AA003IW0

58452-00-9 | 3-(Benzyloxy)-4-methoxybenzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
96%
in stock  
$37.00   $26.00
- +
5g
96%
in stock  
$95.00   $67.00
- +
10g
96%
in stock  
$137.00   $96.00
- +
25g
96%
in stock  
$261.00   $183.00
- +
100g
96%
in stock  
$809.00   $567.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003IW0
Chemical Name:
3-(Benzyloxy)-4-methoxybenzoic acid
CAS Number:
58452-00-9
Molecular Formula:
C15H14O4
Molecular Weight:
258.2693
MDL Number:
MFCD00016526
SMILES:
COc1ccc(cc1OCc1ccccc1)C(=O)O
Properties
Properties
 
Form:
Solid  
MP:
180-182℃  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
286  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
5  
XLogP3:
3.1  

Downstream Synthesis Route

[1]CurrentPatentAssignee:GEFIMS.P.A.-US6340684,2002,B1Locationinpatent:Pagecolumn19

[2]Orrling,KristinaM.;Jansen,Chimed;Vu,XuanLan;Balmer,Vreni;Bregy,Patrick;Shanmugham,Anitha;England,Paul;Bailey,David;Cos,Paul;Maes,Louis;Adams,Emily;VanDenBogaart,Erika;Chatelain,Eric;Ioset,Jean-Robert;VanDeStolpe,Andrea;Zorg,Stèphanie;Veerman,Johan;Seebeck,Thomas;Sterk,GeertJan;DeEsch,IwanJ.P.;Leurs,Rob[JournalofMedicinalChemistry,2012,vol.55,#20,p.8745-8756]

[3]CurrentPatentAssignee:GEFIMS.P.A.-US6589951,2003,B1

[4]CurrentPatentAssignee:GEFIMS.P.A.-US6329370,2001,B1

[5]Wang,Min;Gao,Mingzhang;Mock,BruceH.;Miller,KathyD.;Sledge,GeorgeW.;Hutchins,GaryD.;Zheng,Qi-Huang[BioorganicandMedicinalChemistry,2006,vol.14,#24,p.8599-8607]

[6]Gopinathetal.[ChemischeBerichte,1959,vol.92,p.1657,1660]

[7]Black,DavidSt.C.;Keller,PaulA.;Kumar,Naresh[Tetrahedron,1993,vol.49,#1,p.151-164]

[8]Herbert,RichardB.;Wormald,PeterC.[JournalofChemicalResearch,Miniprint,1982,#11,p.3001-3010]

[9]Napoletano,Mauro;Norcini,Gabriele;Pellacini,Franco;Marchini,Francesco;Morazzoni,Gabriele;Ferlenga,Pierpaolo;Pradella,Lorenzo[BioorganicandMedicinalChemistryLetters,2000,vol.10,#19,p.2235-2238]

[10]Biechy,Aurelien;Hachisu,Shuji;Quiclet-Sire,Beatrice;Ricard,Louis;Zard,SamirZ.[AngewandteChemie-InternationalEdition,2008,vol.47,#8,p.1436-1438]

[11]CurrentPatentAssignee:SUMITOMOCHEMICALCOMPANYLIMITED;SumitomoChemical(w/oDongwooFine-Chem);SumitomoPharma(in:SumitomoChemical)-EP2119702,2009,A1Locationinpatent:Page/Pagecolumn136-137

[12]Locationinpatent:experimentalpartBiechy,Aurélien;Hachisu,Shuji;Quiclet-Sire,Béatrice;Ricard,Louis;Zard,SamirZ.[Tetrahedron,2009,vol.65,#33,p.6730-6738]

[13]Locationinpatent:experimentalpartPrinz,Helge;Chamasmani,Behfar;Vogel,Kirsten;Böhm,KonradJ.;Aicher,Babette;Gerlach,Matthias;Günther,EckhardG.;Amon,Peter;Ivanov,Igor;Müller,Klaus[JournalofMedicinalChemistry,2011,vol.54,#12,p.4247-4263]

[14]Locationinpatent:experimentalpartBland,NicholasD.;Wang,Cuihua;Tallman,Craig;Gustafson,AldenE.;Wang,Zhouxi;Ashton,TrentD.;Ochiana,StefanO.;McAllister,Gregory;Cotter,Kristina;Fang,AnnaP.;Gechijian,Lara;Garceau,Norman;Gangurde,Rajiv;Ortenberg,Ron;Ondrechen,MaryJo;Campbell,RobertK.;Pollastri,MichaelP.[JournalofMedicinalChemistry,2011,vol.54,#23,p.8188-8194]

[15]CurrentPatentAssignee:OTSUKAHOLDINGSCOLTD-WO2014/34958,2014,A1Locationinpatent:Page/Pagecolumn59-60

[16]Yin,Hong;Shangguan,Yingying;Sui,Fengying;Yang,Xinji;Song,Guojie[Lettersindrugdesignanddiscovery,2012,vol.9,#8,p.780-788,9]

[1]OrganicandBiomolecularChemistry,2016,vol.14,p.3061-3068

[2]Patent:WO2015/161830,2015,A1.Locationinpatent:Paragraph00582

[3]JournaloftheChemicalSociety,1930,p.817,818

[4]Patent:WO2007/58338,2007,A2.Locationinpatent:Page/Pagecolumn46

[1]Wang,Min;Gao,Mingzhang;Mock,BruceH.;Miller,KathyD.;Sledge,GeorgeW.;Hutchins,GaryD.;Zheng,Qi-Huang[BioorganicandMedicinalChemistry,2006,vol.14,#24,p.8599-8607]

[2]CurrentPatentAssignee:UCB-WO2020/205501,2020,A1Locationinpatent:Paragraph0388

[3]Napoletano,Mauro;Norcini,Gabriele;Pellacini,Franco;Marchini,Francesco;Morazzoni,Gabriele;Ferlenga,Pierpaolo;Pradella,Lorenzo[BioorganicandMedicinalChemistryLetters,2000,vol.10,#19,p.2235-2238]

[4]CurrentPatentAssignee:GEFIMS.P.A.-US6589951,2003,B1

[5]CurrentPatentAssignee:GEFIMS.P.A.-US6329370,2001,B1

[6]CurrentPatentAssignee:GEFIMS.P.A.-US6340684,2002,B1Locationinpatent:Pagecolumn19

[7]Zhang,Mei;Yang,Xiao-Ying;Tang,Wei;Groeneveld,TomW.L.;He,Pei-Lan;Zhu,Feng-Hua;Li,Jia;Lu,Wei;Blom,AnnaM.;Zuo,Jian-Ping;Nan,Fa-Jun[ACSMedicinalChemistryLetters,2012,vol.3,#4,p.317-321]

[8]CurrentPatentAssignee:ShanghaiInstituteofMateriaMedica(in:CAS);CHINESEACADEMYOFSCIENCES-CN103172543,2016,BLocationinpatent:Paragraph0093;0094;0095

[9]Lovecy;Robinson;Sugasawa[JournaloftheChemicalSociety,1930,p.817,818]

[10]Locationinpatent:schemeortableFukuda,Tsutomu;Ohta,Takeshi;Saeki,Sho;Iwao,Masatomo[Heterocycles,2010,vol.80,#2,p.841-846]

[11]CurrentPatentAssignee:XIANJIAOTONGUNIVERSITY-CN103980152,2016,BLocationinpatent:Paragraph0043-0044

[1]Masood,M.;Tiwari,K.P.[ActaChimicaHungarica,1983,vol.113,#2,p.177-182]

[2]Yang,Kan;Nong,Keyi;Gu,Qinlan;Dong,Jibin;Wang,Jinxin[EuropeanJournalofMedicinalChemistry,2018,vol.151,p.389-400]

[1]Yamato;Hashigaki;Uenishi;Yamakawa;Sato[ChemicalandPharmaceuticalBulletin,1975,vol.23,#12,p.3101-3105]

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Tags:58452-00-9 Molecular Formula|58452-00-9 MDL|58452-00-9 SMILES|58452-00-9 3-(Benzyloxy)-4-methoxybenzoic acid