22530-98-9,MFCD01529601
Catalog No.:AA00BJMR

22530-98-9 | 4-Benzyloxolan-2-one

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$139.00   $97.00
- +
1g
98%
in stock  
$305.00   $214.00
- +
5g
98%
in stock  
$900.00 $630.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00BJMR
Chemical Name:
4-Benzyloxolan-2-one
CAS Number:
22530-98-9
Molecular Formula:
C11H12O2
Molecular Weight:
176.2118
MDL Number:
MFCD01529601
SMILES:
O=C1OCC(C1)Cc1ccccc1
Properties
Computed Properties
 
Complexity:
183  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2  

Downstream Synthesis Route

[1]YukiGoseiKagakuKyokaishi,1959,vol.17,p.461    Chem.Abstr.,1959,p.21794

[1]Chemicalandpharmaceuticalbulletin,1985,vol.33,p.61-66

[1]JournalofMedicinalChemistry,1991,vol.34,p.2242-2247

[1]JournalofMedicinalChemistry,1988,vol.31,p.893-897

[1]ChemicalCommunications,2001,p.331-332

[2]JournalofMedicinalChemistry,1988,vol.31,p.893-897

[3]JournaloftheAmericanChemicalSociety,2012,vol.134,p.11035-11043

Literature
Quotation Request
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Additional Info:
SDS
Tags:22530-98-9 Molecular Formula|22530-98-9 MDL|22530-98-9 SMILES|22530-98-9 4-Benzyloxolan-2-one
Catalog No.: AA00BJMR
22530-98-9,MFCD01529601
22530-98-9 | 4-Benzyloxolan-2-one
Pack Size: 250mg
Purity: 98%
in stock
$139.00 $97.00
Pack Size: 1g
Purity: 98%
in stock
$305.00 $214.00
Pack Size: 5g
Purity: 98%
in stock
$900.00 $630.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00BJMR
Chemical Name: 4-Benzyloxolan-2-one
CAS Number: 22530-98-9
Molecular Formula: C11H12O2
Molecular Weight: 176.2118
MDL Number: MFCD01529601
SMILES: O=C1OCC(C1)Cc1ccccc1
Properties
Complexity: 183  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 1  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2  
Downstream Synthesis Route
87439-00-7    22530-98-9 

[1]YukiGoseiKagakuKyokaishi,1959,vol.17,p.461    Chem.Abstr.,1959,p.21794

22530-98-9    931-59-9    96540-46-4 

[1]Chemicalandpharmaceuticalbulletin,1985,vol.33,p.61-66

22530-98-9    133496-51-2 

[1]JournalofMedicinalChemistry,1991,vol.34,p.2242-2247

22530-98-9    112895-79-1 

[1]JournalofMedicinalChemistry,1988,vol.31,p.893-897

16720-76-6    22530-98-9 

[1]ChemicalCommunications,2001,p.331-332

[2]JournalofMedicinalChemistry,1988,vol.31,p.893-897

[3]JournaloftheAmericanChemicalSociety,2012,vol.134,p.11035-11043

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