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Home Other Building Blocks 100058-55-7
100058-55-7,MFCD19598685
Catalog No.:AA0000PA

100058-55-7 | Benzoic acid, 2-(2-methylpropyl)-

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
97%
1 week  
$209.00   $146.00
- +
100mg
97%
1 week  
$340.00   $238.00
- +
250mg
97%
1 week  
$579.00   $405.00
- +
1g
97%
1 week  
$1,547.00   $1,083.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0000PA
Chemical Name:
Benzoic acid, 2-(2-methylpropyl)-
CAS Number:
100058-55-7
Molecular Formula:
C11H14O2
Molecular Weight:
178.2277
MDL Number:
MFCD19598685
SMILES:
CC(Cc1ccccc1C(=O)O)C
Properties
Computed Properties
 
Complexity:
175  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
3.7  

Downstream Synthesis Route
920-36-5    579-75-9    74-88-4    26507-91-5    100058-55-7    6161-65-5   
isobutyl2-methoxybenzoate 

[1]OrganicLetters,2006,vol.8,p.765-768

[1]Mann;Stewart[JournaloftheChemicalSociety,1954,p.4127,4132]

Literature
Quotation Request
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SDS
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Tags:100058-55-7 Molecular Formula|100058-55-7 MDL|100058-55-7 SMILES|100058-55-7 Benzoic acid, 2-(2-methylpropyl)-