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Home > Other Heterocycles > 2059974-55-7
2059974-55-7 | 4',4'-dimethyl-3-oxaspiro[bicyclo[5.1.0]octane-4,1'-cyclohexane]
CAS No: 2059974-55-7 Catalog No: AG01BZOM MDL No:MFCD30488786
Product Description
Catalog Number:
AG01BZOM
Chemical Name:
4',4'-dimethyl-3-oxaspiro[bicyclo[5.1.0]octane-4,1'-cyclohexane]
CAS Number:
2059974-55-7
Molecular Formula:
C14H24O
Molecular Weight:
208.3398
MDL Number:
MFCD30488786
IUPAC Name:
1',1'-dimethylspiro[3-oxabicyclo[5.1.0]octane-4,4'-cyclohexane]
InChI:
InChI=1S/C14H24O/c1-13(2)5-7-14(8-6-13)4-3-11-9-12(11)10-15-14/h11-12H,3-10H2,1-2H3
InChI Key:
BMRQRRITDRCFQY-UHFFFAOYSA-N
SMILES:
CC1(C)CCC2(CC1)CCC1C(CO2)C1
Properties
Complexity:
246
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:
0
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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