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Home > Other Heterocycles > 877606-85-4
877606-85-4 | Spiro[1-azabicyclo[2.2.2]octane-2,3'-pyrrolidin]-2'-one
CAS No: 877606-85-4 Catalog No: AG004LGS MDL No:
Product Description
Catalog Number:
AG004LGS
Chemical Name:
Spiro[1-azabicyclo[2.2.2]octane-2,3'-pyrrolidin]-2'-one
CAS Number:
877606-85-4
Molecular Formula:
C10H16N2O
Molecular Weight:
180.2468
IUPAC Name:
spiro[1-azabicyclo[2.2.2]octane-2,3'-pyrrolidine]-2'-one
InChI:
InChI=1S/C10H16N2O/c13-9-10(3-4-11-9)7-8-1-5-12(10)6-2-8/h8H,1-7H2,(H,11,13)
InChI Key:
DULBGXZKNRLXLP-UHFFFAOYSA-N
SMILES:
O=C1NCCC21CC1CCN2CC1
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.126g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
180.251g/mol
Monoisotopic Mass:
180.126g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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