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Home > Other Heterocycles > 64661-56-9
64661-56-9 | 2(3H)-Furanone, dihydro-5-(2,6,6-trimethylbicyclo[3.2.0]hept-1-yl)-
CAS No: 64661-56-9 Catalog No: AG00H8ZF MDL No:
Product Description
Catalog Number:
AG00H8ZF
Chemical Name:
2(3H)-Furanone, dihydro-5-(2,6,6-trimethylbicyclo[3.2.0]hept-1-yl)-
CAS Number:
64661-56-9
Molecular Formula:
C14H22O2
Molecular Weight:
222.3233
IUPAC Name:
5-(2,6,6-trimethyl-1-bicyclo[3.2.0]heptanyl)oxolan-2-one
InChI:
InChI=1S/C14H22O2/c1-9-4-5-10-13(2,3)8-14(9,10)11-6-7-12(15)16-11/h9-11H,4-8H2,1-3H3
InChI Key:
FRISKHUTERQGBR-UHFFFAOYSA-N
SMILES:
O=C1CCC(O1)C12CC(C2CCC1C)(C)C
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.162g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.328g/mol
Monoisotopic Mass:
222.162g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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