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Home > Other Heterocycles > 2059955-98-3
2059955-98-3 | 3-oxaspiro[bicyclo[5.1.0]octane-4,1'-cyclopentane]
CAS No: 2059955-98-3 Catalog No: AG01BZOQ MDL No:MFCD30488790
Product Description
Catalog Number:
AG01BZOQ
Chemical Name:
3-oxaspiro[bicyclo[5.1.0]octane-4,1'-cyclopentane]
CAS Number:
2059955-98-3
Molecular Formula:
C11H18O
Molecular Weight:
166.2600
MDL Number:
MFCD30488790
IUPAC Name:
spiro[3-oxabicyclo[5.1.0]octane-4,1'-cyclopentane]
InChI:
InChI=1S/C11H18O/c1-2-5-11(4-1)6-3-9-7-10(9)8-12-11/h9-10H,1-8H2
InChI Key:
DNOQGEFHDQTUJI-UHFFFAOYSA-N
SMILES:
C1CCC2(C1)CCC1C(CO2)C1
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.136g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.264g/mol
Monoisotopic Mass:
166.136g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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