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Home > Other Heterocycles > 1690364-33-0
1690364-33-0 | 3lambda6-thia-7-azabicyclo[3.3.1]nonane-3,3-dione hydrochloride
CAS No: 1690364-33-0 Catalog No: AG01BEPW MDL No:MFCD28505656
Product Description
Catalog Number:
AG01BEPW
Chemical Name:
3lambda6-thia-7-azabicyclo[3.3.1]nonane-3,3-dione hydrochloride
CAS Number:
1690364-33-0
Molecular Formula:
C7H14ClNO2S
Molecular Weight:
211.7096
MDL Number:
MFCD28505656
IUPAC Name:
3λ6-thia-7-azabicyclo[3.3.1]nonane 3,3-dioxide;hydrochloride
InChI:
InChI=1S/C7H13NO2S.ClH/c9-11(10)4-6-1-7(5-11)3-8-2-6;/h6-8H,1-5H2;1H
InChI Key:
FBRNAFRPSPLHOM-UHFFFAOYSA-N
SMILES:
O=S1(=O)CC2CNCC(C1)C2.Cl
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.043g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
211.704g/mol
Monoisotopic Mass:
211.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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