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25142-14-7 | 4H-4,9a-Methanonaphtho[1,2-c]furan-1,3-dione
CAS No: 25142-14-7 Catalog No: AG002QLR MDL No:
Product Description
Catalog Number:
AG002QLR
Chemical Name:
4H-4,9a-Methanonaphtho[1,2-c]furan-1,3-dione
CAS Number:
25142-14-7
Molecular Formula:
C13H8O3
Molecular Weight:
212.2008
IUPAC Name:
11-oxatetracyclo[6.5.1.01,6.09,13]tetradeca-2,4,6,9(13)-tetraene-10,12-dione
InChI:
InChI=1S/C13H8O3/c14-11-9-7-5-8-3-1-2-4-13(8,6-7)10(9)12(15)16-11/h1-5,7H,6H2
InChI Key:
QZGWVZZCHKIKMN-UHFFFAOYSA-N
SMILES:
O=C1OC(=O)C2=C1C13C=CC=CC3=CC2C1
Properties
Complexity:
574
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.047g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.204g/mol
Monoisotopic Mass:
212.047g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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