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Home > Other Heterocycles > 2044712-81-2
2044712-81-2 | 9lambda4-thia-3-azabicyclo[4.2.1]nonan-9-one hydrochloride
CAS No: 2044712-81-2 Catalog No: AG01BVMV MDL No:MFCD30476477
Product Description
Catalog Number:
AG01BVMV
Chemical Name:
9lambda4-thia-3-azabicyclo[4.2.1]nonan-9-one hydrochloride
CAS Number:
2044712-81-2
Molecular Formula:
C7H14ClNOS
Molecular Weight:
195.7102
MDL Number:
MFCD30476477
IUPAC Name:
9λ4-thia-3-azabicyclo[4.2.1]nonane 9-oxide;hydrochloride
InChI:
InChI=1S/C7H13NOS.ClH/c9-10-6-1-2-7(10)5-8-4-3-6;/h6-8H,1-5H2;1H
InChI Key:
WMFKERJWCRFLEF-UHFFFAOYSA-N
SMILES:
O=S1C2CCNCC1CC2.Cl
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.048g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
195.705g/mol
Monoisotopic Mass:
195.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
48.3A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
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