Home Other Building Blocks 5,6,7,8-TETRAHYDRO-1H-CYCLOHEPTA[C]FURAN-1,3(4H)-DIONE

5,6,7,8-TETRAHYDRO-1H-CYCLOHEPTA[C]FURAN-1,3(4H)-DIONE

CAS No.:
10412-04-1
Catalog Number:
AG01DUXS
Molecular Formula:
C9H10O3
Molecular Weight:
166.1739
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Product Description
Catalog Number:
AG01DUXS
Chemical Name:
5,6,7,8-TETRAHYDRO-1H-CYCLOHEPTA[C]FURAN-1,3(4H)-DIONE
CAS Number:
10412-04-1
Molecular Formula:
C9H10O3
Molecular Weight:
166.1739
MDL Number:
MFCD09865945
IUPAC Name:
5,6,7,8-tetrahydro-4H-cyclohepta[c]furan-1,3-dione
InChI:
InChI=1S/C9H10O3/c10-8-6-4-2-1-3-5-7(6)9(11)12-8/h1-5H2
InChI Key:
CVNJOSWQRUPTGE-UHFFFAOYSA-N
SMILES:
O=C1OC(=O)C2=C1CCCCC2
Properties
Complexity:
250  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.063g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.176g/mol
Monoisotopic Mass:
166.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties