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Home > Other Heterocycles > 111722-48-6
111722-48-6 | 6,6-dimethyl-1,5,7-trioxaspiro[2.5]octane
CAS No: 111722-48-6 Catalog No: AG01EK1F MDL No:MFCD29085101
Product Description
Catalog Number:
AG01EK1F
Chemical Name:
6,6-dimethyl-1,5,7-trioxaspiro[2.5]octane
CAS Number:
111722-48-6
Molecular Formula:
C7H12O3
Molecular Weight:
144.1684
MDL Number:
MFCD29085101
IUPAC Name:
6,6-dimethyl-1,5,7-trioxaspiro[2.5]octane
InChI:
InChI=1S/C7H12O3/c1-6(2)8-3-7(4-9-6)5-10-7/h3-5H2,1-2H3
InChI Key:
DSQBODCCEIZOAR-UHFFFAOYSA-N
SMILES:
CC1(C)OCC2(CO1)CO2
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.079g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
144.17g/mol
Monoisotopic Mass:
144.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
31A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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