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Home Amines 140112-97-6
140112-97-6,MFCD00230534
Catalog No.:AA001BYO

140112-97-6 | Benzoic acid, 5-amino-2,4-dimethyl-, methyl ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
1 week  
$212.00   $148.00
- +
500mg
1 week  
$252.00   $176.00
- +
1g
1 week  
$312.00   $218.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA001BYO
Chemical Name:
Benzoic acid, 5-amino-2,4-dimethyl-, methyl ester
CAS Number:
140112-97-6
Molecular Formula:
C10H13NO2
Molecular Weight:
179.2157
MDL Number:
MFCD00230534
SMILES:
COC(=O)c1cc(N)c(cc1C)C
Properties
Properties
 
BP:
300.8°C at 760 mmHg  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
193  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
1.8  

Downstream Synthesis Route

[1]Cabaret;Adediran;GarciaGonzalez;Pratt;Wakselman[JournalofOrganicChemistry,1999,vol.64,#3,p.713-720]

[2]CurrentPatentAssignee:NAVITORPHARMACEUTICALS;NAVITORPHARM-US2018/127370,2018,A1Locationinpatent:Paragraph0358-0359

[3]CurrentPatentAssignee:NAVITORPHARM-WO2018/89433,2018,A1Locationinpatent:Paragraph00313

[1]JournalofOrganicChemistry,1999,vol.64,p.713-720

19125-34-9    140112-97-6   
methyl2,4-dimethyl-5-(1-phenylpiperidin-4-yl)aminobenzoate 

[1]Patent:US2018/127370,2018,A1.Locationinpatent:Paragraph0411-0412

Literature
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SDS
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Tags:140112-97-6 Molecular Formula|140112-97-6 MDL|140112-97-6 SMILES|140112-97-6 Benzoic acid, 5-amino-2,4-dimethyl-, methyl ester