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Home > Other Heterocycles > 72928-26-8
72928-26-8 | Bicyclo[3.2.0]heptan-2-one,6-ethoxy-7-methyl-1-pentyl-
CAS No: 72928-26-8 Catalog No: AG005DWI MDL No:
Product Description
Catalog Number:
AG005DWI
Chemical Name:
Bicyclo[3.2.0]heptan-2-one,6-ethoxy-7-methyl-1-pentyl-
CAS Number:
72928-26-8
Molecular Formula:
C15H26O2
Molecular Weight:
238.3657
IUPAC Name:
6-ethoxy-7-methyl-1-pentylbicyclo[3.2.0]heptan-2-one
InChI:
InChI=1S/C15H26O2/c1-4-6-7-10-15-11(3)14(17-5-2)12(15)8-9-13(15)16/h11-12,14H,4-10H2,1-3H3
InChI Key:
GDKZYNYQEYOOFW-UHFFFAOYSA-N
SMILES:
CCCCCC12C(=O)CCC2C(C1C)OCC
EC Number:
277-060-1
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.193g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.371g/mol
Monoisotopic Mass:
238.193g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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