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Home > Other Heterocycles > 2059945-09-2
2059945-09-2 | 4'-methyl-3-oxaspiro[bicyclo[5.1.0]octane-4,1'-cyclohexane]
CAS No: 2059945-09-2 Catalog No: AG01BZOA MDL No:MFCD30488774
Product Description
Catalog Number:
AG01BZOA
Chemical Name:
4'-methyl-3-oxaspiro[bicyclo[5.1.0]octane-4,1'-cyclohexane]
CAS Number:
2059945-09-2
Molecular Formula:
C13H22O
Molecular Weight:
194.3132
MDL Number:
MFCD30488774
IUPAC Name:
4'-methylspiro[3-oxabicyclo[5.1.0]octane-4,1'-cyclohexane]
InChI:
InChI=1S/C13H22O/c1-10-2-5-13(6-3-10)7-4-11-8-12(11)9-14-13/h10-12H,2-9H2,1H3
InChI Key:
DEBPINHMQDVFPU-UHFFFAOYSA-N
SMILES:
CC1CCC2(CC1)CCC1C(CO2)C1
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.167g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.318g/mol
Monoisotopic Mass:
194.167g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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