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Home > Other Heterocycles > 1419101-41-9
1419101-41-9 | 7-Boc-3-Thia-7,9-diazabicyclo-[3.3.1]nonane-3,3-dioxide
CAS No: 1419101-41-9 Catalog No: AG00HW9P MDL No:
Product Description
Catalog Number:
AG00HW9P
Chemical Name:
7-Boc-3-Thia-7,9-diazabicyclo-[3.3.1]nonane-3,3-dioxide
CAS Number:
1419101-41-9
IUPAC Name:
tert-butyl 3,3-dioxo-3λ6-thia-7,9-diazabicyclo[3.3.1]nonane-7-carboxylate
InChI:
InChI=1S/C11H20N2O4S/c1-11(2,3)17-10(14)13-4-8-6-18(15,16)7-9(5-13)12-8/h8-9,12H,4-7H2,1-3H3
InChI Key:
YCEYYSJVWLIMBL-UHFFFAOYSA-N
Properties
Complexity:
415
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.114g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
276.351g/mol
Monoisotopic Mass:
276.114g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
84.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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