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82242-80-6 | 2(5H)-Furanone, 3-(acetyloxy)-5-methylene-
CAS No: 82242-80-6 Catalog No: AG00500K MDL No:
Product Description
Catalog Number:
AG00500K
Chemical Name:
2(5H)-Furanone, 3-(acetyloxy)-5-methylene-
CAS Number:
82242-80-6
Molecular Formula:
C7H6O4
Molecular Weight:
154.1201
IUPAC Name:
(5-methylidene-2-oxofuran-3-yl) acetate
InChI:
InChI=1S/C7H6O4/c1-4-3-6(7(9)10-4)11-5(2)8/h3H,1H2,2H3
InChI Key:
FURKFHDWKORGKO-UHFFFAOYSA-N
SMILES:
CC(=O)OC1=CC(=C)OC1=O
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.027g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.121g/mol
Monoisotopic Mass:
154.027g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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