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115534-55-9 | Cyclooctanone, 2-chloro-8-(phenylseleno)-
CAS No: 115534-55-9 Catalog No: AG000G4P MDL No:
Product Description
Catalog Number:
AG000G4P
Chemical Name:
Cyclooctanone, 2-chloro-8-(phenylseleno)-
CAS Number:
115534-55-9
Molecular Formula:
C14H17ClOSe
Molecular Weight:
315.6972
IUPAC Name:
2-chloro-8-phenylselanylcyclooctan-1-one
InChI:
InChI=1S/C14H17ClOSe/c15-12-9-5-2-6-10-13(14(12)16)17-11-7-3-1-4-8-11/h1,3-4,7-8,12-13H,2,5-6,9-10H2
InChI Key:
AVCKPXIGRSHRFE-UHFFFAOYSA-N
SMILES:
O=C1C(Cl)CCCCCC1[Se]c1ccccc1
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.013g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
315.71g/mol
Monoisotopic Mass:
316.013g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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