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119944-31-9 | 2(5H)-Furanone, 5-(2-hydroxyethyl)-, (5R)-
CAS No: 119944-31-9 Catalog No: AG000PWA MDL No:
Product Description
Catalog Number:
AG000PWA
Chemical Name:
2(5H)-Furanone, 5-(2-hydroxyethyl)-, (5R)-
CAS Number:
119944-31-9
Molecular Formula:
C6H8O3
Molecular Weight:
128.1259
IUPAC Name:
(2R)-2-(2-hydroxyethyl)-2H-furan-5-one
InChI:
InChI=1S/C6H8O3/c7-4-3-5-1-2-6(8)9-5/h1-2,5,7H,3-4H2/t5-/m0/s1
InChI Key:
SZRRDNZMOSMILH-YFKPBYRVSA-N
SMILES:
OCC[C@H]1OC(=O)C=C1
Properties
Complexity:
139
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
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:
1
Isotope Atom Count:
0
Molecular Weight:
128.127g/mol
Monoisotopic Mass:
128.047g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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