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38428-14-7,MFCD00006702
Catalog No.:AA0034YT

38428-14-7 | Isobutyl 1,2-dihydro-2-isobutoxy-1-quinoline-carboxylate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$10.00   $7.00
- +
5g
95%
in stock  
$25.00   $18.00
- +
25g
97%
in stock  
$97.00   $68.00
- +
100g
97%
in stock  
$354.00 $248.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0034YT
Chemical Name:
Isobutyl 1,2-dihydro-2-isobutoxy-1-quinoline-carboxylate
CAS Number:
38428-14-7
Molecular Formula:
C18H25NO3
Molecular Weight:
303.3960
MDL Number:
MFCD00006702
SMILES:
CC(COC(=O)N1C(OCC(C)C)C=Cc2c1cccc2)C
NSC Number:
332545
Properties
Properties
 
BP:
377.9°C at 760 mmHg  
Form:
Liquid  
Refractive Index:
n20/D 1.523(lit.)  
Storage:
2-8℃;  

Computed Properties
 
Complexity:
392  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
6  
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0  
XLogP3:
4.7  

Downstream Synthesis Route
Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Use of polystyrene-supported 2-isobutoxy-1-isobutoxycarbonyl-1,2-dihydroquinoline for the preparation of a hapten-protein conjugate for antibody development.

Journal: Bioorganic & medicinal chemistry letters 20100301

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SDS
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Tags:38428-14-7 Molecular Formula|38428-14-7 MDL|38428-14-7 SMILES|38428-14-7 Isobutyl 1,2-dihydro-2-isobutoxy-1-quinoline-carboxylate
Catalog No.: AA0034YT
38428-14-7,MFCD00006702
38428-14-7 | Isobutyl 1,2-dihydro-2-isobutoxy-1-quinoline-carboxylate
Pack Size： 1g
Purity： 95%
in stock
$10.00 $7.00
Pack Size： 5g
Purity： 95%
in stock
$25.00 $18.00
Pack Size： 25g
Purity： 97%
in stock
$97.00 $68.00
Pack Size： 100g
Purity： 97%
in stock
$354.00 $248.00
Quantity
- +
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bulk Quotation Request
Technical Information
Catalog Number: AA0034YT
Chemical Name: Isobutyl 1,2-dihydro-2-isobutoxy-1-quinoline-carboxylate
CAS Number: 38428-14-7
Molecular Formula: C18H25NO3
Molecular Weight: 303.3960
MDL Number: MFCD00006702
SMILES: CC(COC(=O)N1C(OCC(C)C)C=Cc2c1cccc2)C
NSC Number: 332545
Properties
BP: 377.9°C at 760 mmHg  
Form: Liquid  
Refractive Index: n20/D 1.523(lit.)  
Storage: 2-8℃;  
Complexity: 392  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 22  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 6  
Undefined Atom Stereocenter Count: 1  
Undefined Bond Stereocenter Count: 0  
XLogP3: 4.7  
Downstream Synthesis Route
Literature fold

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters20101101

Title: Use of polystyrene-supported 2-isobutoxy-1-isobutoxycarbonyl-1,2-dihydroquinoline for the preparation of a hapten-protein conjugate for antibody development.

Journal: Bioorganic & medicinal chemistry letters20100301

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