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Home > Other Heterocycles > 141336-05-2
141336-05-2 | 6-(benzenesulfonyl)-6-azabicyclo[3.1.0]hexane
CAS No: 141336-05-2 Catalog No: AG01B68V MDL No:MFCD30476116
Product Description
Catalog Number:
AG01B68V
Chemical Name:
6-(benzenesulfonyl)-6-azabicyclo[3.1.0]hexane
CAS Number:
141336-05-2
Molecular Formula:
C11H13NO2S
Molecular Weight:
223.2914
MDL Number:
MFCD30476116
IUPAC Name:
6-(benzenesulfonyl)-6-azabicyclo[3.1.0]hexane
InChI:
InChI=1S/C11H13NO2S/c13-15(14,9-5-2-1-3-6-9)12-10-7-4-8-11(10)12/h1-3,5-6,10-11H,4,7-8H2
InChI Key:
ZKPXYAMAGDPPHO-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1ccccc1)N1C2C1CCC2
NSC Number:
617632
Properties
Complexity:
330
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.067g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.29g/mol
Monoisotopic Mass:
223.067g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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