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10193-26-7 | 4,7-Methanoisobenzofuran-1,3-dione, 3a,4,7,7a-tetrahydro-8-(2-propen-1-yl)-
CAS No: 10193-26-7 Catalog No: AG0005ZE MDL No:
Product Description
Catalog Number:
AG0005ZE
Chemical Name:
4,7-Methanoisobenzofuran-1,3-dione, 3a,4,7,7a-tetrahydro-8-(2-propen-1-yl)-
CAS Number:
10193-26-7
Molecular Formula:
C12H12O3
Molecular Weight:
204.2219
IUPAC Name:
10-prop-2-enyl-4-oxatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
InChI:
InChI=1S/C12H12O3/c1-2-3-6-7-4-5-8(6)10-9(7)11(13)15-12(10)14/h2,4-10H,1,3H2
InChI Key:
UAOSUOQUDOREIP-UHFFFAOYSA-N
SMILES:
C=CCC1C2C=CC1C1C2C(=O)OC1=O
EC Number:
233-476-5
Properties
Complexity:
352
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.079g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.225g/mol
Monoisotopic Mass:
204.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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