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Home > Other Heterocycles > 109640-45-1
109640-45-1 | 5-thia-8-azaspiro[3.4]octane
CAS No: 109640-45-1 Catalog No: AG01BKF8 MDL No:MFCD23920108
Product Description
Catalog Number:
AG01BKF8
Chemical Name:
5-thia-8-azaspiro[3.4]octane
CAS Number:
109640-45-1
Molecular Formula:
C6H11NS
Molecular Weight:
129.2232
MDL Number:
MFCD23920108
IUPAC Name:
5-thia-8-azaspiro[3.4]octane
InChI:
InChI=1S/C6H11NS/c1-2-6(3-1)7-4-5-8-6/h7H,1-5H2
InChI Key:
FESTXUIXVBKJRG-UHFFFAOYSA-N
SMILES:
C1CC2(C1)NCCS2
Properties
Complexity:
98.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
129.061g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
129.221g/mol
Monoisotopic Mass:
129.061g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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