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Home > Other Heterocycles > 909565-02-2
909565-02-2 | Bicyclo[3.1.0]hexan-2-one, 1-(1-naphthalenylsulfonyl)-, (1R,5R)-
CAS No: 909565-02-2 Catalog No: AG006SMN MDL No:
Product Description
Catalog Number:
AG006SMN
Chemical Name:
Bicyclo[3.1.0]hexan-2-one, 1-(1-naphthalenylsulfonyl)-, (1R,5R)-
CAS Number:
909565-02-2
Molecular Formula:
C16H14O3S
Molecular Weight:
286.3456
IUPAC Name:
(1R,5R)-1-naphthalen-1-ylsulfonylbicyclo[3.1.0]hexan-2-one
InChI:
InChI=1S/C16H14O3S/c17-15-9-8-12-10-16(12,15)20(18,19)14-7-3-5-11-4-1-2-6-13(11)14/h1-7,12H,8-10H2/t12-,16-/m1/s1
InChI Key:
IEVWZRMTYHOZCQ-MLGOLLRUSA-N
SMILES:
O=C1CC[C@H]2[C@@]1(C2)S(=O)(=O)c1cccc2c1cccc2
Properties
Complexity:
532
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
286.066g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.345g/mol
Monoisotopic Mass:
286.066g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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