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Home > Other Heterocycles > 1803603-33-9
1803603-33-9 | 6-thia-3-azabicyclo[3.2.1]octane hydrochloride
CAS No: 1803603-33-9 Catalog No: AG01BBAX MDL No:MFCD28505936
Product Description
Catalog Number:
AG01BBAX
Chemical Name:
6-thia-3-azabicyclo[3.2.1]octane hydrochloride
CAS Number:
1803603-33-9
Molecular Formula:
C6H12ClNS
Molecular Weight:
165.6842
MDL Number:
MFCD28505936
IUPAC Name:
6-thia-3-azabicyclo[3.2.1]octane;hydrochloride
InChI:
InChI=1S/C6H11NS.ClH/c1-5-2-7-3-6(1)8-4-5;/h5-7H,1-4H2;1H
InChI Key:
DKYJUIUWDNNDMD-UHFFFAOYSA-N
SMILES:
N1CC2SCC(C1)C2.Cl
Properties
Complexity:
94.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.038g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
165.679g/mol
Monoisotopic Mass:
165.038g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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