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28911-34-4 | 4-Morpholineacetic acid, α-oxo-
CAS No: 28911-34-4 Catalog No: AG002X2L MDL No:MFCD09971265
Product Description
Catalog Number:
AG002X2L
Chemical Name:
4-Morpholineacetic acid, α-oxo-
CAS Number:
28911-34-4
Molecular Formula:
C6H9NO4
Molecular Weight:
159.1400
MDL Number:
MFCD09971265
IUPAC Name:
2-morpholin-4-yl-2-oxoacetic acid
InChI:
InChI=1S/C6H9NO4/c8-5(6(9)10)7-1-3-11-4-2-7/h1-4H2,(H,9,10)
InChI Key:
PNEYYXXAPCEGCL-UHFFFAOYSA-N
SMILES:
O=C(C(=O)O)N1CCOCC1
Properties
Complexity:
173
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:
1
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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