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65486-09-1

65486-09-1 | 4-Thia-1-azabicyclo[5.2.0]nonan-9-one

CAS No: 65486-09-1 Catalog No: AG006Q50 MDL No:

Product Description

Catalog Number:
AG006Q50
Chemical Name:
4-Thia-1-azabicyclo[5.2.0]nonan-9-one
CAS Number:
65486-09-1
Molecular Formula:
C7H11NOS
Molecular Weight:
157.2333
IUPAC Name:
4-thia-1-azabicyclo[5.2.0]nonan-9-one
InChI:
InChI=1S/C7H11NOS/c9-7-5-6-1-3-10-4-2-8(6)7/h6H,1-5H2
InChI Key:
SOGPALDDVGHDAX-UHFFFAOYSA-N
SMILES:
O=C1CC2N1CCSCC2

Properties

Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.056g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
157.231g/mol
Monoisotopic Mass:
157.056g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  

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