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853934-40-4 | Spiro[1,3-benzodiselenole-2,1'-cyclohexane]-2',6'-dione
CAS No: 853934-40-4 Catalog No: AG004TM3 MDL No:
Product Description
Catalog Number:
AG004TM3
Chemical Name:
Spiro[1,3-benzodiselenole-2,1'-cyclohexane]-2',6'-dione
CAS Number:
853934-40-4
Molecular Formula:
C12H10O2Se2
Molecular Weight:
344.1266
IUPAC Name:
spiro[1,3-benzodiselenole-2,2'-cyclohexane]-1',3'-dione
InChI:
InChI=1S/C12H10O2Se2/c13-10-6-3-7-11(14)12(10)15-8-4-1-2-5-9(8)16-12/h1-2,4-5H,3,6-7H2
InChI Key:
QZJNIWZFVVLYBB-UHFFFAOYSA-N
SMILES:
O=C1CCCC(=O)C21[Se]c1c([Se]2)cccc1
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
345.901g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
344.152g/mol
Monoisotopic Mass:
345.901g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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