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Home > Other Heterocycles > 113646-66-5
113646-66-5 | Ethanone, 1-(2,2-dimethyl-1,4,8-triazaspiro[4.5]dec-8-yl)-
CAS No: 113646-66-5 Catalog No: AG00098E MDL No:
Product Description
Catalog Number:
AG00098E
Chemical Name:
Ethanone, 1-(2,2-dimethyl-1,4,8-triazaspiro[4.5]dec-8-yl)-
CAS Number:
113646-66-5
Molecular Formula:
C11H21N3O
Molecular Weight:
211.3039
IUPAC Name:
1-(3,3-dimethyl-1,4,8-triazaspiro[4.5]decan-8-yl)ethanone
InChI:
InChI=1S/C11H21N3O/c1-9(15)14-6-4-11(5-7-14)12-8-10(2,3)13-11/h12-13H,4-8H2,1-3H3
InChI Key:
BWXXZDMBKKNOCQ-UHFFFAOYSA-N
SMILES:
CC(=O)N1CCC2(CC1)NCC(N2)(C)C
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.168g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
211.309g/mol
Monoisotopic Mass:
211.168g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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