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1916-08-1,MFCD00002508
Catalog No.:AA003JGS

1916-08-1 | 3-Hydroxy-4,5-dimethoxybenzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
98%
2 weeks  
$105.00   $74.00
- +
250mg
98%
2 weeks  
$150.00   $105.00
- +
500mg
98%
2 weeks  
$193.00   $135.00
- +
1g
98%
2 weeks  
$265.00   $185.00
- +
5g
98
2 weeks  
$965.00   $675.00
- +
10g
98
2 weeks  
$1,500.00   $1,050.00
- +
25g
98
2 weeks  
$2,750.00   $1,925.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003JGS
Chemical Name:
3-Hydroxy-4,5-dimethoxybenzoic acid
CAS Number:
1916-08-1
Molecular Formula:
C9H10O5
Molecular Weight:
198.1727
MDL Number:
MFCD00002508
SMILES:
COc1cc(cc(c1OC)O)C(=O)O
NSC Number:
19885
Properties
Properties
 
BP:
374.2℃°C at 761 mmHg  
Form:
Solid  
MP:
197-198°C  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
205  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
3  
XLogP3:
1  

Downstream Synthesis Route

[1]BioorganicandMedicinalChemistry,2011,vol.19,p.6042-6054

[2]JournalofOrganicChemistry,1999,vol.64,p.5321-5324

[3]ChemischeBerichte,1928,vol.61,p.347

[4]MonatsheftefurChemie,1904,vol.25,p.513

[5]JournaloftheChemicalSociety.PerkintransactionsI,1970,vol.9,p.1219-1223

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

[7]Patent:EP1217000,2002,A1.Locationinpatent:Page29

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

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

[1]OrientalJournalofChemistry,2018,vol.34,p.655-662

[2]OrientalJournalofChemistry,2018,vol.34,p.295-300

[3]MonatsheftefurChemie,1902,vol.23,p.707    MonatsheftefuerChemie,1904,vol.25,p.506

[4]MonatsheftefurChemie,1904,vol.25,p.513

[1]Ghinet,Alina;Rigo,Benoît;Hénichart,Jean-Pierre;LeBroc-Ryckewaert,Delphine;Pommery,Jean;Pommery,Nicole;Thuru,Xavier;Quesnel,Bruno;Gautret,Philippe[BioorganicandMedicinalChemistry,2011,vol.19,#20,p.6042-6054]

[2]Baker;Downing;Floyd;Gilbert;Ollis[JournaloftheChemicalSociety.PerkintransactionsI,1970,vol.9,p.1219-1223]

[3]Malhotra,S.;Misra,K.[IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,1982,vol.21,#1,p.27-29]

[1]Patent:US2002/198195,2002,A1

Literature

Title: Biotransformation of gallic acid by Beauveria sulfurescens ATCC 7159.

Journal: Applied microbiology and biotechnology 20070301

Title: Proton dissociation is important to understanding structure-activity relationships of gallic acid antioxidants.

Journal: Bioorganic & medicinal chemistry letters 20060801

Title: Benzoic acid derivatives in a hypogastrurid collembolan: temperature-dependent formation and biological significance as deterrents.

Journal: Journal of chemical ecology 20040801

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SDS
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Tags:1916-08-1 Molecular Formula|1916-08-1 MDL|1916-08-1 SMILES|1916-08-1 3-Hydroxy-4,5-dimethoxybenzoic acid
Catalog No.: AA003JGS
1916-08-1,MFCD00002508
1916-08-1 | 3-Hydroxy-4,5-dimethoxybenzoic acid
Pack Size： 100mg
Purity： 98%
2 weeks
$105.00 $74.00
Pack Size： 250mg
Purity： 98%
2 weeks
$150.00 $105.00
Pack Size： 500mg
Purity： 98%
2 weeks
$193.00 $135.00
Pack Size： 1g
Purity： 98%
2 weeks
$265.00 $185.00
Pack Size： 5g
Purity： 98
2 weeks
$965.00 $675.00
Pack Size： 10g
Purity： 98
2 weeks
$1,500.00 $1,050.00
Pack Size： 25g
Purity： 98
2 weeks
$2,750.00 $1,925.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA003JGS
Chemical Name: 3-Hydroxy-4,5-dimethoxybenzoic acid
CAS Number: 1916-08-1
Molecular Formula: C9H10O5
Molecular Weight: 198.1727
MDL Number: MFCD00002508
SMILES: COc1cc(cc(c1OC)O)C(=O)O
NSC Number: 19885
Properties
BP: 374.2℃°C at 761 mmHg  
Form: Solid  
MP: 197-198°C  
Storage: Keep in dry area;2-8℃;  
Complexity: 205  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 14  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 2  
Rotatable Bond Count: 3  
XLogP3: 1  
Downstream Synthesis Route
67-56-1    1916-08-1    83011-43-2 

[1]BioorganicandMedicinalChemistry,2011,vol.19,p.6042-6054

[2]JournalofOrganicChemistry,1999,vol.64,p.5321-5324

[3]ChemischeBerichte,1928,vol.61,p.347

[4]MonatsheftefurChemie,1904,vol.25,p.513

[5]JournaloftheChemicalSociety.PerkintransactionsI,1970,vol.9,p.1219-1223

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

[7]Patent:EP1217000,2002,A1.Locationinpatent:Page29

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

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

83011-43-2    1916-08-1 

[1]OrientalJournalofChemistry,2018,vol.34,p.655-662

[2]OrientalJournalofChemistry,2018,vol.34,p.295-300

[3]MonatsheftefurChemie,1902,vol.23,p.707    MonatsheftefuerChemie,1904,vol.25,p.506

[4]MonatsheftefurChemie,1904,vol.25,p.513

149-91-7    77-78-1    1916-08-1 

[1]Ghinet,Alina;Rigo,Benoît;Hénichart,Jean-Pierre;LeBroc-Ryckewaert,Delphine;Pommery,Jean;Pommery,Nicole;Thuru,Xavier;Quesnel,Bruno;Gautret,Philippe[BioorganicandMedicinalChemistry,2011,vol.19,#20,p.6042-6054]

[2]Baker;Downing;Floyd;Gilbert;Ollis[JournaloftheChemicalSociety.PerkintransactionsI,1970,vol.9,p.1219-1223]

[3]Malhotra,S.;Misra,K.[IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,1982,vol.21,#1,p.27-29]

1916-08-1    83011-43-2 

[1]Patent:US2002/198195,2002,A1

Literature fold

Title: Biotransformation of gallic acid by Beauveria sulfurescens ATCC 7159.

Journal: Applied microbiology and biotechnology20070301

Title: Proton dissociation is important to understanding structure-activity relationships of gallic acid antioxidants.

Journal: Bioorganic & medicinal chemistry letters20060801

Title: Benzoic acid derivatives in a hypogastrurid collembolan: temperature-dependent formation and biological significance as deterrents.

Journal: Journal of chemical ecology20040801

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