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42058-59-3,MFCD00017660
Catalog No.:AA003RI3

42058-59-3 | 3-Hydroxyphenylacetic acid methyl ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$7.00   $5.00
- +
5g
95%
in stock  
$32.00   $22.00
- +
10g
95%
in stock  
$56.00   $39.00
- +
25g
95%
in stock  
$123.00   $86.00
- +
100g
95%
in stock  
$419.00   $294.00
- +
500g
95%
in stock  
$1,693.00   $1,185.00
- +
  • 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:
AA003RI3
Chemical Name:
3-Hydroxyphenylacetic acid methyl ester
CAS Number:
42058-59-3
Molecular Formula:
C9H10O3
Molecular Weight:
166.1739
MDL Number:
MFCD00017660
SMILES:
COC(=O)Cc1cccc(c1)O
Properties
Properties
 
BP:
277.7±15.0°C at 760 mmHg  
Form:
Liquid  
Refractive Index:
1.5340 to 1.5380  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
156  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
1.2  

Upstream Synthesis Route

[1]BulletinoftheChemicalSocietyofJapan,1989,vol.62,#1,p.153-158

[1]Patent:EP2716640,2014,A1,.Locationinpatent:Page/Pagecolumn

[1]BioorganicandMedicinalChemistryLetters,2006,vol.16,#21,p.5488-5492

[2]Patent:WO2004/63155,2004,A1,.Locationinpatent:Page58

[3]Patent:WO2005/66136,2005,A1,.Locationinpatent:Page/Pagecolumn51

[4]Patent:WO2005/19190,2005,A2,.Locationinpatent:Page/Pagecolumn51

[5]Patent:WO2005/103050,2005,A2,.Locationinpatent:Page/Pagecolumn168

[6]Patent:WO2007/56366,2007,A2,.Locationinpatent:Page/Pagecolumn30

[7]Patent:WO2004/41813,2004,A1,.Locationinpatent:Page113-114

[8]BioorganicandMedicinalChemistryLetters,2009,vol.19,#19,p.5617-5621

[9]Patent:WO2007/56497,2007,A1,.Locationinpatent:Page/Pagecolumn26

[10]ChemicalandPharmaceuticalBulletin,2011,vol.59,#8,p.1029-1037

[11]Patent:WO2005/105780,2005,A2,.Locationinpatent:Page/Pagecolumn72

[12]Patent:WO2005/60958,2005,A1,.Locationinpatent:Page/Pagecolumn144-145

[13]Patent:US2007/219193,2007,A1,.Locationinpatent:Page/Pagecolumn12;21-22

[14]Patent:WO2003/82802,2003,A1,.Locationinpatent:Page/Pagecolumn41

[15]Patent:WO2004/43939,2004,A1,.Locationinpatent:Page56

[16]BioorganicandMedicinalChemistryLetters,2009,vol.19,#19,p.5617-5621

[17]OrganicLetters,2012,vol.14,#23,p.5820-5823

[18]Patent:WO2004/101528,2004,A2,.Locationinpatent:Page227

[19]Patent:US2003/225122,2003,A1,.Locationinpatent:Page21

[20]Patent:US2009/30082,2009,A1,.Locationinpatent:Page/Pagecolumn7;Sheet4/5

[21]JournalofMedicinalChemistry,1999,vol.42,#21,p.4394-4404

[22]ChemMedChem,2017,vol.12,#20,p.1693-1696

[23]EuropeanJournalofMedicinalChemistry,2014,vol.86,p.714-723

[24]JournalofMedicinalChemistry,2018,vol.61,#7,p.2753-2775

[25]Patent:WO2010/138901,2010,A1,.Locationinpatent:Page/Pagecolumn109

[26]Patent:WO2005/102997,2005,A1,.Locationinpatent:Page/Pagecolumn40

[27]BioorganicandMedicinalChemistry,2000,vol.8,#7,p.1757-1766

[28]EuropeanJournalofOrganicChemistry,2003,#17,p.3407-3411

[29]JournalofMedicinalChemistry,2017,vol.60,#1,p.441-457

[30]AdvancedSynthesisandCatalysis,2017,vol.359,#6,p.959-965

[31]JournalofMedicinalChemistry,2005,vol.48,#13,p.4312-4331

[32]JournalofOrganicChemistry,2006,vol.71,#15,p.5594-5598

[33]Patent:EP1602642,2005,A1,.Locationinpatent:Page/Pagecolumn22-23

[34]Patent:US2005/288318,2005,A1,.Locationinpatent:Page/Pagecolumn11

[35]BioorganicandMedicinalChemistryLetters,2010,vol.20,#20,p.6125-6128

[36]Patent:WO2011/51375,2011,A1,.Locationinpatent:Page/Pagecolumn14

[37]Patent:EP2316820,2011,A1,.Locationinpatent:Page/Pagecolumn7

[38]Patent:WO2013/78123,2013,A1,.Locationinpatent:Page/Pagecolumn104

[39]EuropeanJournalofMedicinalChemistry,2015,vol.93,p.156-171

[40]ACSMedicinalChemistryLetters,2017,vol.8,#3,p.287-292

[41]Patent:WO2009/102893,2009,A2,.Locationinpatent:Page/Pagecolumn102

[42]Patent:WO2009/145989,2009,A2,.Locationinpatent:Page/Pagecolumn90

[43]Patent:WO2004/101528,2004,A2,.Locationinpatent:Page143

[1]Patent:WO2004/63184,2004,A1,.Locationinpatent:Page53

[2]Patent:US2002/52397,2002,A1,

[3]Patent:US5550152,1996,A,

[4]Patent:US5348962,1994,A,

[1]Patent:WO2006/57922,2006,A2,.Locationinpatent:Page/Pagecolumn34-35

Downstream Synthesis Route

[1]ChemicalandPharmaceuticalBulletin,1984,vol.32,p.3047-3052

[1]BioorganicandMedicinalChemistryLetters,2006,vol.16,p.5488-5492

[2]Patent:WO2004/63155,2004,A1.Locationinpatent:Page58

[3]Patent:WO2005/66136,2005,A1.Locationinpatent:Page/Pagecolumn51

[4]Patent:WO2005/19190,2005,A2.Locationinpatent:Page/Pagecolumn51

[5]Patent:WO2005/103050,2005,A2.Locationinpatent:Page/Pagecolumn168

[6]Patent:WO2007/56366,2007,A2.Locationinpatent:Page/Pagecolumn30

[7]Patent:WO2004/41813,2004,A1.Locationinpatent:Page113-114

[8]BioorganicandMedicinalChemistryLetters,2009,vol.19,p.5617-5621

[9]Patent:WO2007/56497,2007,A1.Locationinpatent:Page/Pagecolumn26

[10]ChemicalandPharmaceuticalBulletin,2011,vol.59,p.1029-1037

[11]Patent:WO2005/105780,2005,A2.Locationinpatent:Page/Pagecolumn72

[12]Patent:WO2005/60958,2005,A1.Locationinpatent:Page/Pagecolumn144-145

[13]Patent:US2007/219193,2007,A1.Locationinpatent:Page/Pagecolumn12;21-22

[14]Patent:WO2003/82802,2003,A1.Locationinpatent:Page/Pagecolumn41

[15]Patent:WO2004/43939,2004,A1.Locationinpatent:Page56

[16]BioorganicandMedicinalChemistryLetters,2009,vol.19,p.5617-5621

[17]OrganicLetters,2012,vol.14,p.5820-5823

[18]Patent:WO2004/101528,2004,A2.Locationinpatent:Page227

[19]Patent:CN111269125,2020,A.Locationinpatent:Paragraph0154-0156

[20]Patent:US2003/225122,2003,A1.Locationinpatent:Page21

[21]Patent:US2009/30082,2009,A1.Locationinpatent:Page/Pagecolumn7;Sheet4/5

[22]JournalofMedicinalChemistry,1999,vol.42,p.4394-4404

[23]ChemMedChem,2017,vol.12,p.1693-1696

[24]EuropeanJournalofMedicinalChemistry,2014,vol.86,p.714-723

[25]JournalofMedicinalChemistry,2018,vol.61,p.2753-2775

[26]Patent:WO2010/138901,2010,A1.Locationinpatent:Page/Pagecolumn109

[27]Patent:WO2005/102997,2005,A1.Locationinpatent:Page/Pagecolumn40

[28]BioorganicandMedicinalChemistry,2000,vol.8,p.1757-1766

[29]EuropeanJournalofOrganicChemistry,2003,p.3407-3411

[30]JournalofMedicinalChemistry,2017,vol.60,p.441-457

[31]AdvancedSynthesisandCatalysis,2017,vol.359,p.959-965

[32]JournalofMedicinalChemistry,2005,vol.48,p.4312-4331

[33]JournalofOrganicChemistry,2006,vol.71,p.5594-5598

[34]Patent:EP1602642,2005,A1.Locationinpatent:Page/Pagecolumn22-23

[35]Patent:US2005/288318,2005,A1.Locationinpatent:Page/Pagecolumn11

[36]BioorganicandMedicinalChemistryLetters,2010,vol.20,p.6125-6128

[37]Patent:WO2011/51375,2011,A1.Locationinpatent:Page/Pagecolumn14

[38]Patent:EP2316820,2011,A1.Locationinpatent:Page/Pagecolumn7

[39]Patent:WO2013/78123,2013,A1.Locationinpatent:Page/Pagecolumn104

[40]EuropeanJournalofMedicinalChemistry,2015,vol.93,p.156-171

[41]ACSMedicinalChemistryLetters,2017,vol.8,p.287-292

[42]Patent:WO2009/102893,2009,A2.Locationinpatent:Page/Pagecolumn102

[43]Patent:WO2009/145989,2009,A2.Locationinpatent:Page/Pagecolumn90

[44]Patent:WO2004/101528,2004,A2.Locationinpatent:Page143

[1]JournalofMedicinalChemistry,2003,vol.46,p.3709-3727

[2]JournalofMedicinalChemistry,2005,vol.48,p.4312-4331

[3]JournalofOrganicChemistry,2006,vol.71,p.5594-5598

[4]BioorganicandMedicinalChemistryLetters,2006,vol.16,p.5488-5492

[5]Patent:WO2006/57922,2006,A2.Locationinpatent:Page/Pagecolumn34-35

[6]Patent:WO2011/51375,2011,A1.Locationinpatent:Page/Pagecolumn14

[7]Patent:EP2316820,2011,A1.Locationinpatent:Page/Pagecolumn7-8

[1]BioorganicandMedicinalChemistryLetters,2006,vol.16,p.5488-5492

[1]Epple,Robert;Azimioara,Mihai;Russo,Ross;Xie,Yongping;Wang,Xing;Cow,Christopher;Wityak,John;Karanewsky,Don;Bursulaya,Badry;Kreusch,Andreas;Tuntland,Tove;Gerken,Andrea;Iskandar,Maya;Saez,Enrique;MartinSeidel;Tian,Shin-Shay[BioorganicandMedicinalChemistryLetters,2006,vol.16,#21,p.5488-5492]

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