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Home > Other Heterocycles > 405889-71-6
405889-71-6 | 2',6'-dioxospiro[adamantane-2,4'-piperidine]-3',5'-dicarbonitrile
CAS No: 405889-71-6 Catalog No: AG01AFZG MDL No:
Product Description
Catalog Number:
AG01AFZG
Chemical Name:
2',6'-dioxospiro[adamantane-2,4'-piperidine]-3',5'-dicarbonitrile
CAS Number:
405889-71-6
Molecular Formula:
C16H17N3O2
Molecular Weight:
283.3251
IUPAC Name:
2',6'-dioxospiro[adamantane-2,4'-piperidine]-3',5'-dicarbonitrile
InChI:
InChI=1S/C16H17N3O2/c17-6-12-14(20)19-15(21)13(7-18)16(12)10-2-8-1-9(4-10)5-11(16)3-8/h8-13H,1-5H2,(H,19,20,21)
InChI Key:
FLTLJEIOJAIIQJ-UHFFFAOYSA-N
SMILES:
N#CC1C(=O)NC(=O)C(C21C1CC3CC2CC(C1)C3)C#N
Properties
Complexity:
570
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.132g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
283.331g/mol
Monoisotopic Mass:
283.132g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
93.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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