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Home > Other Heterocycles > 2059945-12-7
2059945-12-7 | 5'-ethyl-3-oxaspiro[bicyclo[5.1.0]octane-4,1'-cyclohexane]
CAS No: 2059945-12-7 Catalog No: AG01BZOO MDL No:MFCD30488788
Product Description
Catalog Number:
AG01BZOO
Chemical Name:
5'-ethyl-3-oxaspiro[bicyclo[5.1.0]octane-4,1'-cyclohexane]
CAS Number:
2059945-12-7
Molecular Formula:
C14H24O
Molecular Weight:
208.3398
MDL Number:
MFCD30488788
IUPAC Name:
3'-ethylspiro[3-oxabicyclo[5.1.0]octane-4,1'-cyclohexane]
InChI:
InChI=1S/C14H24O/c1-2-11-4-3-6-14(9-11)7-5-12-8-13(12)10-15-14/h11-13H,2-10H2,1H3
InChI Key:
OUYZCZSPJKQBBZ-UHFFFAOYSA-N
SMILES:
CCC1CCCC2(C1)CCC1C(CO2)C1
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.183g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.345g/mol
Monoisotopic Mass:
208.183g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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