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Home Other Building Blocks 5-Phenylhexahydro-4,7-methanoisobenzofuran-1,3-dione

5-Phenylhexahydro-4,7-methanoisobenzofuran-1,3-dione

CAS No.:
73252-09-2
Catalog Number:
AG00FW37
Molecular Formula:
C15H14O3
Molecular Weight:
242.2699
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
In Stock USA
United States
$89
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250mg
In Stock USA
United States
$172
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500mg
In Stock USA
United States
$283
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1g
In Stock USA
United States
$491
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Product Description
Catalog Number:
AG00FW37
Chemical Name:
5-Phenylhexahydro-4,7-methanoisobenzofuran-1,3-dione
CAS Number:
73252-09-2
Molecular Formula:
C15H14O3
Molecular Weight:
242.2699
MDL Number:
MFCD13873730
IUPAC Name:
8-phenyl-4-oxatricyclo[5.2.1.02,6]decane-3,5-dione
InChI:
InChI=1S/C15H14O3/c16-14-12-9-6-10(8-4-2-1-3-5-8)11(7-9)13(12)15(17)18-14/h1-5,9-13H,6-7H2
InChI Key:
QVZKCYULUXLGPJ-UHFFFAOYSA-N
SMILES:
O=C1OC(=O)C2C1C1CC2CC1c1ccccc1
Properties
Complexity:
397  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.094g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.274g/mol
Monoisotopic Mass:
242.094g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
5  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties