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879127-67-0 | Sodium 3,5-dioxotetrahydro-2H-pyran-4-ide
CAS No: 879127-67-0 Catalog No: AG004FF3 MDL No:MFCD24698144
Product Description
Catalog Number:
AG004FF3
Chemical Name:
Sodium 3,5-dioxotetrahydro-2H-pyran-4-ide
CAS Number:
879127-67-0
Molecular Formula:
C5H5NaO3
Molecular Weight:
136.0812
MDL Number:
MFCD24698144
IUPAC Name:
sodium;pyran-4-ide-3,5-dione
InChI:
InChI=1S/C5H5O3.Na/c6-4-1-5(7)3-8-2-4;/h1H,2-3H2;/q-1;+1
InChI Key:
HZHSOBOQRRNIDJ-UHFFFAOYSA-N
SMILES:
O=C1COCC(=O)[CH-]1.[Na+]
Properties
Complexity:
118
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.014g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
136.082g/mol
Monoisotopic Mass:
136.014g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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