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Home > Other Heterocycles > 1823947-89-2
1823947-89-2 | 2lambda6-thia-6-azaspiro[3.4]octane-2,2-dione
CAS No: 1823947-89-2 Catalog No: AG01BXQX MDL No:MFCD27664939
Product Description
Catalog Number:
AG01BXQX
Chemical Name:
2lambda6-thia-6-azaspiro[3.4]octane-2,2-dione
CAS Number:
1823947-89-2
Molecular Formula:
C6H11NO2S
Molecular Weight:
161.2220
MDL Number:
MFCD27664939
IUPAC Name:
2λ6-thia-7-azaspiro[3.4]octane 2,2-dioxide
InChI:
InChI=1S/C6H11NO2S/c8-10(9)4-6(5-10)1-2-7-3-6/h7H,1-5H2
InChI Key:
XPXUEUZFGJHRTK-UHFFFAOYSA-N
SMILES:
O=S1(=O)CC2(C1)CNCC2
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.051g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
161.219g/mol
Monoisotopic Mass:
161.051g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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