Home Carboxys 2-oxo-1,3-oxazinane-4-carboxylic acid

2-oxo-1,3-oxazinane-4-carboxylic acid

CAS No.:
1543317-50-5
Catalog Number:
AG01C24A
Molecular Formula:
C5H7NO4
Molecular Weight:
145.1134
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Product Description
Catalog Number:
AG01C24A
Chemical Name:
2-oxo-1,3-oxazinane-4-carboxylic acid
CAS Number:
1543317-50-5
Molecular Formula:
C5H7NO4
Molecular Weight:
145.1134
MDL Number:
MFCD24496456
IUPAC Name:
2-oxo-1,3-oxazinane-4-carboxylic acid
InChI:
InChI=1S/C5H7NO4/c7-4(8)3-1-2-10-5(9)6-3/h3H,1-2H2,(H,6,9)(H,7,8)
InChI Key:
NWPSPESEXGPUGH-UHFFFAOYSA-N
SMILES:
O=C1OCCC(N1)C(=O)O
Properties
Complexity:
167  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.038g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
145.114g/mol
Monoisotopic Mass:
145.038g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties