Home Other Building Blocks 2-(2-oxo-1,3-oxazinan-3-yl)acetic acid

2-(2-oxo-1,3-oxazinan-3-yl)acetic acid

CAS No.:
1190392-66-5
Catalog Number:
AG019YYO
Molecular Formula:
C6H9NO4
Molecular Weight:
159.1400
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Product Description
Catalog Number:
AG019YYO
Chemical Name:
2-(2-oxo-1,3-oxazinan-3-yl)acetic acid
CAS Number:
1190392-66-5
Molecular Formula:
C6H9NO4
Molecular Weight:
159.1400
MDL Number:
MFCD14626906
IUPAC Name:
2-(2-oxo-1,3-oxazinan-3-yl)acetic acid
InChI:
InChI=1S/C6H9NO4/c8-5(9)4-7-2-1-3-11-6(7)10/h1-4H2,(H,8,9)
InChI Key:
DZGYGTNFBYWKFM-UHFFFAOYSA-N
SMILES:
OC(=O)CN1CCCOC1=O
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.053g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
159.141g/mol
Monoisotopic Mass:
159.053g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties