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1197-80-4

1197-80-4 | 2-Azaspiro[4.5]decane-1,3-dione

CAS No: 1197-80-4 Catalog No: AG000PHL MDL No:MFCD04037986

Product Description

Catalog Number:
AG000PHL
Chemical Name:
2-Azaspiro[4.5]decane-1,3-dione
CAS Number:
1197-80-4
Molecular Formula:
C9H13NO2
Molecular Weight:
167.2050
MDL Number:
MFCD04037986
IUPAC Name:
2-azaspiro[4.5]decane-1,3-dione
InChI:
InChI=1S/C9H13NO2/c11-7-6-9(8(12)10-7)4-2-1-3-5-9/h1-6H2,(H,10,11,12)
InChI Key:
BBZBYWMNNPPFKA-UHFFFAOYSA-N
SMILES:
O=C1NC(=O)C2(C1)CCCCC2
NSC Number:
130583

Properties

Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.095g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
167.208g/mol
Monoisotopic Mass:
167.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  

Literature

Title Journal
Synthesis, physicochemical and anticonvulsant properties of new N-phenylamino derivatives of 2-azaspiro[4.4]nonane- and [4.5]decane-1,3-diones: part V. European journal of medicinal chemistry 20080101
Synthesis and anticonvulsant properties of new N-phenylamino derivatives of 2-azaspiro[4.4]nonane, 2-azaspiro[4.5]decane-1,3-dione and 3-cyclohexylpyrrolidine-2,5-dione. Part IV. Acta poloniae pharmaceutica 20060101
Synthesis, physicochemical and anticonvulsant properties of N-benzyl and N-aminophenyl derivatives of 2-azaspiro[4.4]nonane and [4.5]decane-1,3-dione. Part I. Farmaco (Societa chimica italiana : 1989) 20050101

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