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117615-50-6 | 2,5-Furandione, 3-ethoxy-
CAS No: 117615-50-6 Catalog No: AG000HJA MDL No:
Product Description
Catalog Number:
AG000HJA
Chemical Name:
2,5-Furandione, 3-ethoxy-
CAS Number:
117615-50-6
Molecular Formula:
C6H6O4
Molecular Weight:
142.1094
IUPAC Name:
3-ethoxyfuran-2,5-dione
InChI:
InChI=1S/C6H6O4/c1-2-9-4-3-5(7)10-6(4)8/h3H,2H2,1H3
InChI Key:
PFASSPYFJVNBQQ-UHFFFAOYSA-N
SMILES:
CCOC1=CC(=O)OC1=O
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.027g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
142.11g/mol
Monoisotopic Mass:
142.027g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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