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Home Carboxes 86718-07-2
86718-07-2,MFCD03425368
Catalog No.:AA003Q5W

86718-07-2 | Ethyl 4-(1H-imidazol-1-yl)benzoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$17.00   $12.00
- +
1g
98%
in stock  
$45.00   $32.00
- +
5g
98%
in stock  
$162.00   $113.00
- +
10g
98%
in stock  
$253.00   $177.00
- +
25g
98%
in stock  
$494.00   $346.00
- +
100g
98%
in stock  
$1,482.00   $1,038.00
- +
  • 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:
AA003Q5W
Chemical Name:
Ethyl 4-(1H-imidazol-1-yl)benzoate
CAS Number:
86718-07-2
Molecular Formula:
C12H12N2O2
Molecular Weight:
216.2359
MDL Number:
MFCD03425368
SMILES:
CCOC(=O)c1ccc(cc1)n1cncc1
Properties
Properties
 
BP:
366 °C at 760 mmHg  
Form:
Solid  
Storage:
Room Temperature;  

Computed Properties
 
Complexity:
237  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
4  
XLogP3:
1.9  

Upstream Synthesis Route

[1]EuropeanJournalofMedicinalChemistry,1992,vol.27,#3,p.219-228

[1]EuropeanJournalofMedicinalChemistry,1992,vol.27,#3,p.219-228

[2]Tetrahedron,2002,vol.58,#17,p.3361-3370

[3]Patent:US5238953,1993,A,

[4]Patent:US4962115,1990,A,

Downstream Synthesis Route

[1]EuropeanJournalofMedicinalChemistry,1992,vol.27,p.219-228

[2]Patent:US6359134,2002,B1.Locationinpatent:Referentialexample16

[3]GreenChemistry,2011,vol.13,p.2071-2077

[1]EuropeanJournalofMedicinalChemistry,1992,vol.27,p.219-228

[2]Tetrahedron,2002,vol.58,p.3361-3370

[3]Patent:US5238953,1993,A

[4]Patent:US4962115,1990,A

[1]EuropeanJournalofMedicinalChemistry,1992,vol.27,p.219-228

[1]JournalofMedicinalChemistry,1990,vol.33,p.1091-1097

[1]Patent:US5238953,1993,A

Literature
Quotation Request
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Additional Info:
SDS
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Tags:86718-07-2 Molecular Formula|86718-07-2 MDL|86718-07-2 SMILES|86718-07-2 Ethyl 4-(1H-imidazol-1-yl)benzoate