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1249024-78-9

1249024-78-9 | 8-Azabicyclo[3.2.1]octan-3-amine, 8-(methylsulfonyl)-

CAS No: 1249024-78-9 Catalog No: AG000MUP MDL No:MFCD14602631

Product Description

Catalog Number:
AG000MUP
Chemical Name:
8-Azabicyclo[3.2.1]octan-3-amine, 8-(methylsulfonyl)-
CAS Number:
1249024-78-9
Molecular Formula:
C8H16N2O2S
Molecular Weight:
204.2898
MDL Number:
MFCD14602631
IUPAC Name:
8-methylsulfonyl-8-azabicyclo[3.2.1]octan-3-amine
InChI:
InChI=1S/C8H16N2O2S/c1-13(11,12)10-7-2-3-8(10)5-6(9)4-7/h6-8H,2-5,9H2,1H3
InChI Key:
WCTCMYLESNOTNP-UHFFFAOYSA-N
SMILES:
NC1CC2CCC(C1)N2S(=O)(=O)C

Properties

Complexity:
282  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.093g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
204.288g/mol
Monoisotopic Mass:
204.093g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  

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