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29393-32-6 | 2(3H)-Furanone, 5-acetyldihydro-
CAS No: 29393-32-6 Catalog No: AG002Y96 MDL No:MFCD00276569
Product Description
Catalog Number:
AG002Y96
Chemical Name:
2(3H)-Furanone, 5-acetyldihydro-
CAS Number:
29393-32-6
Molecular Formula:
C6H8O3
Molecular Weight:
128.1259
MDL Number:
MFCD00276569
IUPAC Name:
5-acetyloxolan-2-one
InChI:
InChI=1S/C6H8O3/c1-4(7)5-2-3-6(8)9-5/h5H,2-3H2,1H3
InChI Key:
AHLDCEZSQNGEFT-UHFFFAOYSA-N
SMILES:
O=C1CCC(O1)C(=O)C
EC Number:
249-603-2
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.047g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
128.127g/mol
Monoisotopic Mass:
128.047g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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