Home Other Building Blocks 1-phenyl-3-oxabicyclo[3.1.0]hexane-2,4-dione

1-phenyl-3-oxabicyclo[3.1.0]hexane-2,4-dione

CAS No.:
710-97-4
Catalog Number:
AG019TR3
Molecular Formula:
C11H8O3
Molecular Weight:
188.1794
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Product Description
Catalog Number:
AG019TR3
Chemical Name:
1-phenyl-3-oxabicyclo[3.1.0]hexane-2,4-dione
CAS Number:
710-97-4
Molecular Formula:
C11H8O3
Molecular Weight:
188.1794
MDL Number:
MFCD22053539
IUPAC Name:
1-phenyl-3-oxabicyclo[3.1.0]hexane-2,4-dione
InChI:
InChI=1S/C11H8O3/c12-9-8-6-11(8,10(13)14-9)7-4-2-1-3-5-7/h1-5,8H,6H2
InChI Key:
VRVFLPPXIRCEOE-UHFFFAOYSA-N
SMILES:
O=C1OC(=O)C2C1(C2)c1ccccc1
Properties
Complexity:
304  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.047g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.182g/mol
Monoisotopic Mass:
188.047g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties