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111714-47-7,MFCD11656627
Catalog No.:AA007SBG

111714-47-7 | Methyl 3-acetyl-4-aminobenzoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$98.00   $69.00
- +
1g
95%
in stock  
$120.00   $84.00
- +
5g
95%
in stock  
$597.00   $418.00
- +
10g
95%
in stock  
$1,074.00   $752.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA007SBG
Chemical Name:
Methyl 3-acetyl-4-aminobenzoate
CAS Number:
111714-47-7
Molecular Formula:
C10H11NO3
Molecular Weight:
193.1992
MDL Number:
MFCD11656627
SMILES:
COC(=O)c1ccc(c(c1)C(=O)C)N
Properties
Computed Properties
 
Complexity:
240  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.3  

Synonyms
 
  
Downstream Synthesis Route

[1]JournalofMedicinalChemistry,1987,vol.30,p.1918-1928

[1]JournalofOrganicChemistry,1997,vol.62,p.4088-4096

[2]TetrahedronLetters,1996,vol.37,p.2903-2906

[3]BioorganicandMedicinalChemistry,2009,vol.17,p.1307-1324

[4]Patent:WO2006/64286,2006,A1.Locationinpatent:Page/Pagecolumn117

[5]Patent:WO2007/144379,2007,A1.Locationinpatent:Page/Pagecolumn48

124-63-0    111714-47-7   
C11H13NO5S 

[1]Patent:WO2007/144379,2007,A1.Locationinpatent:Page/Pagecolumn48-49

[1]JournalofMedicinalChemistry,1987,vol.30,p.1918-1928

[1]JournalofMedicinalChemistry,1987,vol.30,p.1918-1928

Literature
Quotation Request
Company Name:
*
Contact Person:
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Email:
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Quantity Required:
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Additional Info:
Submit
SDS
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Tags:111714-47-7 Molecular Formula|111714-47-7 MDL|111714-47-7 SMILES|111714-47-7 Methyl 3-acetyl-4-aminobenzoate
Catalog No.: AA007SBG
111714-47-7,MFCD11656627
111714-47-7 | Methyl 3-acetyl-4-aminobenzoate
Pack Size： 250mg
Purity： 95%
in stock
$98.00 $69.00
Pack Size： 1g
Purity： 95%
in stock
$120.00 $84.00
Pack Size： 5g
Purity： 95%
in stock
$597.00 $418.00
Pack Size： 10g
Purity： 95%
in stock
$1,074.00 $752.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA007SBG
Chemical Name: Methyl 3-acetyl-4-aminobenzoate
CAS Number: 111714-47-7
Molecular Formula: C10H11NO3
Molecular Weight: 193.1992
MDL Number: MFCD11656627
SMILES: COC(=O)c1ccc(c(c1)C(=O)C)N
Properties
Complexity: 240  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 14  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.3  
26:   
Downstream Synthesis Route
99573-20-3    111714-47-7    110144-35-9 

[1]JournalofMedicinalChemistry,1987,vol.30,p.1918-1928

177913-49-4    111714-47-7 

[1]JournalofOrganicChemistry,1997,vol.62,p.4088-4096

[2]TetrahedronLetters,1996,vol.37,p.2903-2906

[3]BioorganicandMedicinalChemistry,2009,vol.17,p.1307-1324

[4]Patent:WO2006/64286,2006,A1.Locationinpatent:Page/Pagecolumn117

[5]Patent:WO2007/144379,2007,A1.Locationinpatent:Page/Pagecolumn48

124-63-0    111714-47-7   
C11H13NO5S 

[1]Patent:WO2007/144379,2007,A1.Locationinpatent:Page/Pagecolumn48-49

111714-47-7    110144-41-7 

[1]JournalofMedicinalChemistry,1987,vol.30,p.1918-1928

111714-47-7    110144-36-0 

[1]JournalofMedicinalChemistry,1987,vol.30,p.1918-1928

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