59956-48-8,MFCD17014696
Catalog No.:AA00EZ3T

59956-48-8 | Isobutyl bromoacetate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
95%
3 weeks  
$152.00   $107.00
- +
100mg
95%
3 weeks  
$206.00   $144.00
- +
250mg
95%
3 weeks  
$265.00   $185.00
- +
500mg
95%
3 weeks  
$447.00   $313.00
- +
1g
95%
3 weeks  
$618.00   $433.00
- +
2.5g
95%
3 weeks  
$1,154.00   $808.00
- +
5g
95%
3 weeks  
$1,679.00   $1,175.00
- +
10g
95%
3 weeks  
$2,461.00   $1,723.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00EZ3T
Chemical Name:
Isobutyl bromoacetate
CAS Number:
59956-48-8
Molecular Formula:
C6H11BrO2
Molecular Weight:
195.0543
MDL Number:
MFCD17014696
SMILES:
BrCC(=O)OCC(C)C
Properties
Properties
 
Storage:
2-8℃;  

Computed Properties
 
Complexity:
91.1  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.2  

Downstream Synthesis Route
59956-48-8    59-46-1   
diethyl-2-(4-amino-benzoyloxy)-ethyl-isobutoxycarbonylmethyl-ammonium;bromide 

[1]ActaChimicaAcademiaeScientiarumHungaricae,1953,vol.3,p.497,498

625-56-9    59956-48-8   
isobutyl3-acetoxypropionate 

[1]JournalofOrganicChemistryUSSR(EnglishTranslation),1968,vol.4,p.1120-1121    ZhurnalOrganicheskoiKhimii,1968,vol.4,p.1165-1167

[1]Baker,Hannah;Ferreira,LiamD.;Gayler,KevinM.;Kane,RobertR.;Karunananthan,JohannW.;Kostyo,JessicaH.;Martin,Emil;Mattke,Jordan;Nguyen,Harold;Plunk,MichaelA.;Quintana,JeremyM.;Sharina,Iraida;Shuda,Mina;Stinchcomb,AlexandraL.[EuropeanJournalofMedicinalChemistry,2021,vol.224]

Literature
Quotation Request
Company Name:
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Quantity Required:
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Additional Info:
SDS
Tags:59956-48-8 Molecular Formula|59956-48-8 MDL|59956-48-8 SMILES|59956-48-8 Isobutyl bromoacetate
Catalog No.: AA00EZ3T
59956-48-8,MFCD17014696
59956-48-8 | Isobutyl bromoacetate
Pack Size: 50mg
Purity: 95%
3 weeks
$152.00 $107.00
Pack Size: 100mg
Purity: 95%
3 weeks
$206.00 $144.00
Pack Size: 250mg
Purity: 95%
3 weeks
$265.00 $185.00
Pack Size: 500mg
Purity: 95%
3 weeks
$447.00 $313.00
Pack Size: 1g
Purity: 95%
3 weeks
$618.00 $433.00
Pack Size: 2.5g
Purity: 95%
3 weeks
$1,154.00 $808.00
Pack Size: 5g
Purity: 95%
3 weeks
$1,679.00 $1,175.00
Pack Size: 10g
Purity: 95%
3 weeks
$2,461.00 $1,723.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00EZ3T
Chemical Name: Isobutyl bromoacetate
CAS Number: 59956-48-8
Molecular Formula: C6H11BrO2
Molecular Weight: 195.0543
MDL Number: MFCD17014696
SMILES: BrCC(=O)OCC(C)C
Properties
Storage: 2-8℃;  
Complexity: 91.1  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 9  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.2  
Downstream Synthesis Route
59956-48-8    59-46-1   
diethyl-2-(4-amino-benzoyloxy)-ethyl-isobutoxycarbonylmethyl-ammonium;bromide 

[1]ActaChimicaAcademiaeScientiarumHungaricae,1953,vol.3,p.497,498

625-56-9    59956-48-8   
isobutyl3-acetoxypropionate 

[1]JournalofOrganicChemistryUSSR(EnglishTranslation),1968,vol.4,p.1120-1121    ZhurnalOrganicheskoiKhimii,1968,vol.4,p.1165-1167

95-87-4    59956-48-8    7356-41-4 

[1]Baker,Hannah;Ferreira,LiamD.;Gayler,KevinM.;Kane,RobertR.;Karunananthan,JohannW.;Kostyo,JessicaH.;Martin,Emil;Mattke,Jordan;Nguyen,Harold;Plunk,MichaelA.;Quintana,JeremyM.;Sharina,Iraida;Shuda,Mina;Stinchcomb,AlexandraL.[EuropeanJournalofMedicinalChemistry,2021,vol.224]

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