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132209-83-7 | 2(3H)-Furanone, 5-ethyl-3-heptyldihydro-
CAS No: 132209-83-7 Catalog No: AG0010DJ MDL No:
Product Description
Catalog Number:
AG0010DJ
Chemical Name:
2(3H)-Furanone, 5-ethyl-3-heptyldihydro-
CAS Number:
132209-83-7
Molecular Formula:
C13H24O2
Molecular Weight:
212.3285
IUPAC Name:
5-ethyl-3-heptyloxolan-2-one
InChI:
InChI=1S/C13H24O2/c1-3-5-6-7-8-9-11-10-12(4-2)15-13(11)14/h11-12H,3-10H2,1-2H3
InChI Key:
NAXZWHLYHOASKL-UHFFFAOYSA-N
SMILES:
CCCCCCCC1CC(OC1=O)CC
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.178g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.333g/mol
Monoisotopic Mass:
212.178g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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