Home Carboxys Rac-(1s,2r,4r)-6-oxo-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid

Rac-(1s,2r,4r)-6-oxo-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid

CAS No.:
2008714-56-3
Catalog Number:
AG00J3F4
Molecular Formula:
C7H8O4
Molecular Weight:
156.1360
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$448
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Product Description
Catalog Number:
AG00J3F4
Chemical Name:
Rac-(1s,2r,4r)-6-oxo-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
CAS Number:
2008714-56-3
Molecular Formula:
C7H8O4
Molecular Weight:
156.1360
MDL Number:
MFCD29760293
IUPAC Name:
(1S,2R,4R)-6-oxo-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
InChI:
InChI=1S/C7H8O4/c8-5-2-3-1-4(7(9)10)6(5)11-3/h3-4,6H,1-2H2,(H,9,10)/t3-,4-,6+/m1/s1
InChI Key:
QRADTXZVQNFLSA-KODRXGBYSA-N
SMILES:
OC(=O)[C@@H]1C[C@H]2O[C@@H]1C(=O)C2
Properties
Complexity:
223  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
3  
Defined Bond Stereocenter Count:
0
Exact Mass:
156.042g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
156.137g/mol
Monoisotopic Mass:
156.042g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6  
Properties