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Home > Other Heterocycles > 1823912-45-3
1823912-45-3 | 3-(TERT-BUTYLSULFANYL)-8-AZABICYCLO[3.2.1]OCTANE HYDROCHLORIDE
CAS No: 1823912-45-3 Catalog No: AG01AT18 MDL No:MFCD26793137
Product Description
Catalog Number:
AG01AT18
Chemical Name:
3-(TERT-BUTYLSULFANYL)-8-AZABICYCLO[3.2.1]OCTANE HYDROCHLORIDE
CAS Number:
1823912-45-3
Molecular Formula:
C11H22ClNS
Molecular Weight:
235.8171
MDL Number:
MFCD26793137
IUPAC Name:
3-tert-butylsulfanyl-8-azabicyclo[3.2.1]octane;hydrochloride
InChI:
InChI=1S/C11H21NS.ClH/c1-11(2,3)13-10-6-8-4-5-9(7-10)12-8;/h8-10,12H,4-7H2,1-3H3;1H
InChI Key:
DEGHBTCLDRSKFV-UHFFFAOYSA-N
SMILES:
CC(SC1CC2CCC(C1)N2)(C)C.Cl
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.116g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
235.814g/mol
Monoisotopic Mass:
235.116g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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