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6900-16-9

6900-16-9 | 2-oxo-4-phenyl-1-oxaspiro[4.5]decane-3-carboxamide

CAS No: 6900-16-9 Catalog No: AG006DUP MDL No:

Product Description

Catalog Number:
AG006DUP
Chemical Name:
2-oxo-4-phenyl-1-oxaspiro[4.5]decane-3-carboxamide
CAS Number:
6900-16-9
Molecular Formula:
C16H19NO3
Molecular Weight:
273.3270
IUPAC Name:
2-oxo-4-phenyl-1-oxaspiro[4.5]decane-3-carboxamide
InChI:
InChI=1S/C16H19NO3/c17-14(18)12-13(11-7-3-1-4-8-11)16(20-15(12)19)9-5-2-6-10-16/h1,3-4,7-8,12-13H,2,5-6,9-10H2,(H2,17,18)
InChI Key:
WTQCPJASTOLFQC-UHFFFAOYSA-N
SMILES:
NC(=O)C1C(=O)OC2(C1c1ccccc1)CCCCC2
NSC Number:
108976

Properties

Complexity:
395  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.136g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
273.332g/mol
Monoisotopic Mass:
273.136g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
69.4A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

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