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Home > Other Building Blocks > 115093-29-3
115093-29-3 | 2(5H)-Furanone, 3-ethyl-5-methyl-, (5R)-
CAS No: 115093-29-3 Catalog No: AG000FWB MDL No:
Product Description
Catalog Number:
AG000FWB
Chemical Name:
2(5H)-Furanone, 3-ethyl-5-methyl-, (5R)-
CAS Number:
115093-29-3
Molecular Formula:
C7H10O2
Molecular Weight:
126.1531
IUPAC Name:
4-ethyl-2-methyl-2H-furan-5-one
InChI:
InChI=1S/C7H10O2/c1-3-6-4-5(2)9-7(6)8/h4-5H,3H2,1-2H3
InChI Key:
UKEBBUSJICRZKR-UHFFFAOYSA-N
SMILES:
CCC1=C[C@H](OC1=O)C
Properties
Complexity:
158
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.068g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
126.155g/mol
Monoisotopic Mass:
126.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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