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13480-36-9 | 4-Methylmorpholine-2,6-dione
CAS No: 13480-36-9 Catalog No: AG00392A MDL No:
Product Description
Catalog Number:
AG00392A
Chemical Name:
4-Methylmorpholine-2,6-dione
CAS Number:
13480-36-9
Molecular Formula:
C5H7NO3
Molecular Weight:
129.1140
IUPAC Name:
4-methylmorpholine-2,6-dione
InChI:
InChI=1S/C5H7NO3/c1-6-2-4(7)9-5(8)3-6/h2-3H2,1H3
InChI Key:
FGQJBZHMORPBRR-UHFFFAOYSA-N
SMILES:
CN1CC(=O)OC(=O)C1
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
129.043g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
129.115g/mol
Monoisotopic Mass:
129.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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