Home Other Building Blocks 2-oxatricyclo[5.4.0.0,3,5]undeca-1(11),7,9-trien-6-one

2-oxatricyclo[5.4.0.0,3,5]undeca-1(11),7,9-trien-6-one

CAS No.:
65596-88-5
Catalog Number:
AG01DWKU
Molecular Formula:
C10H8O2
Molecular Weight:
160.1693
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Product Description
Catalog Number:
AG01DWKU
Chemical Name:
2-oxatricyclo[5.4.0.0,3,5]undeca-1(11),7,9-trien-6-one
CAS Number:
65596-88-5
Molecular Formula:
C10H8O2
Molecular Weight:
160.1693
MDL Number:
MFCD24694119
IUPAC Name:
1a,7a-dihydro-1H-cyclopropa[b]chromen-7-one
InChI:
InChI=1S/C10H8O2/c11-10-6-3-1-2-4-8(6)12-9-5-7(9)10/h1-4,7,9H,5H2
InChI Key:
DQYKWUOLGDGKNU-UHFFFAOYSA-N
SMILES:
O=C1C2CC2Oc2c1cccc2
Properties
Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.052g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.172g/mol
Monoisotopic Mass:
160.052g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties