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128244-00-8

128244-00-8 | 1,7-Diazaspiro[4.4]nonan-6-one, 1-benzoyl-

CAS No: 128244-00-8 Catalog No: AG000XWT MDL No:

Product Description

Catalog Number:
AG000XWT
Chemical Name:
1,7-Diazaspiro[4.4]nonan-6-one, 1-benzoyl-
CAS Number:
128244-00-8
Molecular Formula:
C14H16N2O2
Molecular Weight:
244.2890
IUPAC Name:
1-benzoyl-1,7-diazaspiro[4.4]nonan-6-one
InChI:
InChI=1S/C14H16N2O2/c17-12(11-5-2-1-3-6-11)16-10-4-7-14(16)8-9-15-13(14)18/h1-3,5-6H,4,7-10H2,(H,15,18)
InChI Key:
OIQRTEVAOMPNDH-UHFFFAOYSA-N
SMILES:
O=C1NCCC21CCCN2C(=O)c1ccccc1

Properties

Complexity:
363  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.121g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
244.294g/mol
Monoisotopic Mass:
244.121g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

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