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Home > Other Heterocycles > 2059974-48-8
2059974-48-8 | 3',3',5'-trimethyl-3-oxaspiro[bicyclo[5.1.0]octane-4,1'-cyclohexane]
CAS No: 2059974-48-8 Catalog No: AG01BZO8 MDL No:MFCD30488772
Product Description
Catalog Number:
AG01BZO8
Chemical Name:
3',3',5'-trimethyl-3-oxaspiro[bicyclo[5.1.0]octane-4,1'-cyclohexane]
CAS Number:
2059974-48-8
Molecular Formula:
C15H26O
Molecular Weight:
222.3663
MDL Number:
MFCD30488772
IUPAC Name:
1',1',5'-trimethylspiro[3-oxabicyclo[5.1.0]octane-4,3'-cyclohexane]
InChI:
InChI=1S/C15H26O/c1-11-7-14(2,3)10-15(8-11)5-4-12-6-13(12)9-16-15/h11-13H,4-10H2,1-3H3
InChI Key:
HBZVKOYFKQMFFG-UHFFFAOYSA-N
SMILES:
CC1CC2(CCC3C(CO2)C3)CC(C1)(C)C
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.198g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.372g/mol
Monoisotopic Mass:
222.198g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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