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3556-86-3,MFCD00213808
Catalog No.:AA00I6ZB

3556-86-3 | Methyl 3-hydroxy-4-methylbenzoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$12.00   $8.00
- +
1g
98%
in stock  
$14.00   $10.00
- +
5g
98%
in stock  
$66.00   $47.00
- +
25g
97%
in stock  
$279.00   $195.00
- +
100g
97%
in stock  
$779.00   $545.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00I6ZB
Chemical Name:
Methyl 3-hydroxy-4-methylbenzoate
CAS Number:
3556-86-3
Molecular Formula:
C9H10O3
Molecular Weight:
166.1739
MDL Number:
MFCD00213808
SMILES:
CC1=C(C=C(C=C1)C(=O)OC)O
NSC Number:
604566
Properties
Computed Properties
 
Complexity:
167  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
1.9  

Downstream Synthesis Route
3556-86-3    81156-68-5   
3-2-(2,4-dichloro-phenyl)-ethoxy-4-methyl-benzoicacidmethylester 

[1]BioorganicandMedicinalChemistryLetters,2004,vol.14,p.2801-2805

[2]JournalofMedicinalChemistry,2005,vol.48,p.3290-3312

[1]OrganicandBiomolecularChemistry,2005,vol.3,p.3629-3635

[2]Patent:WO2010/28981,2010,A1.Locationinpatent:Page/Pagecolumn56-57

[3]Patent:WO2003/82802,2003,A1.Locationinpatent:Page/Pagecolumn48-49

[4]Patent:WO2009/53277,2009,A1.Locationinpatent:Page/Pagecolumn49

[5]Patent:WO2008/107365,2008,A1.Locationinpatent:Page/Pagecolumn66-67

[6]Patent:WO2007/104695,2007,A1.Locationinpatent:Page/Pagecolumn30

[7]JournalofMedicinalChemistry,2005,vol.48,p.3290-3312

[8]JournalofMedicinalChemistry,2008,vol.51,p.1333-1343

[9]BioorganicandMedicinalChemistry,2008,vol.16,p.6724-6731

[10]BioorganicandMedicinalChemistryLetters,2009,vol.19,p.4673-4678

[11]AngewandteChemie-InternationalEdition,2016,vol.55,p.7821-7825    Angew.Chem.,2016,vol.128,p.7952-7956,5

[12]JournalofOrganicChemistry,2018,vol.83,p.9667-9681

[13]Patent:WO2006/100036,2006,A1.Locationinpatent:Page/Pagecolumn176

[1]Patent:US2003/181496,2003,A1

[2]Patent:EP1479384,2004,A1

[1]CurrentPatentAssignee:Novartis(w/oSandoz);NOVARTISAG-WO2006/100036,2006,A1Locationinpatent:Page/Pagecolumn176-177

[1]Patent:US5238958,1993,A

Literature
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SDS
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Tags:3556-86-3 Molecular Formula|3556-86-3 MDL|3556-86-3 SMILES|3556-86-3 Methyl 3-hydroxy-4-methylbenzoate