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Home Other Building Blocks 1,3-Oxazinan-2-one

1,3-Oxazinan-2-one

CAS No.:
5259-97-2
Catalog Number:
AG003DLC
Molecular Formula:
C4H7NO2
Molecular Weight:
101.1039
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$88
- +
5g
96%
In Stock USA
United States
$275
- +
10g
96%
In Stock USA
United States
$519
- +
25g
96%
In Stock USA
United States
$1025
- +
Product Description
Catalog Number:
AG003DLC
Chemical Name:
1,3-Oxazinan-2-one
CAS Number:
5259-97-2
Molecular Formula:
C4H7NO2
Molecular Weight:
101.1039
MDL Number:
MFCD11109147
IUPAC Name:
1,3-oxazinan-2-one
InChI:
InChI=1S/C4H7NO2/c6-4-5-2-1-3-7-4/h1-3H2,(H,5,6)
InChI Key:
OYELEBBISJGNHJ-UHFFFAOYSA-N
SMILES:
O=C1NCCCO1
Properties
Complexity:
81.8  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
101.048g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
101.105g/mol
Monoisotopic Mass:
101.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Literature
Title Journal
Structure-based design and synthesis of 1,3-oxazinan-2-one inhibitors of 11β-hydroxysteroid dehydrogenase type 1. Journal of medicinal chemistry 20110908
Urea based CCR3 antagonists employing a tetrahydro-1,3-oxazin-2-one spacer. Bioorganic & medicinal chemistry letters 20090101
Synthesis and antibacterial activities of chiral 1,3-oxazinan-2-one derivatives. Bioorganic & medicinal chemistry letters 20060415
Properties