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Home > Other Heterocycles > 2059940-43-9
2059940-43-9 | 5'-(propan-2-yl)-3-oxaspiro[bicyclo[5.1.0]octane-4,1'-cyclohexane]
CAS No: 2059940-43-9 Catalog No: AG01BZON MDL No:MFCD30488787
Product Description
Catalog Number:
AG01BZON
Chemical Name:
5'-(propan-2-yl)-3-oxaspiro[bicyclo[5.1.0]octane-4,1'-cyclohexane]
CAS Number:
2059940-43-9
Molecular Formula:
C15H26O
Molecular Weight:
222.3663
MDL Number:
MFCD30488787
IUPAC Name:
3'-propan-2-ylspiro[3-oxabicyclo[5.1.0]octane-4,1'-cyclohexane]
InChI:
InChI=1S/C15H26O/c1-11(2)13-4-3-6-15(9-13)7-5-12-8-14(12)10-16-15/h11-14H,3-10H2,1-2H3
InChI Key:
NGGFZKBFTICMJR-UHFFFAOYSA-N
SMILES:
CC(C1CCCC2(C1)CCC1C(CO2)C1)C
Properties
Complexity:
260
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:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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