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Home > Other Heterocycles > 78649-62-4
78649-62-4 | 1,4-Dioxaspiro[4.4]nonane,2-butyl-
CAS No: 78649-62-4 Catalog No: AG0058SC MDL No:
Product Description
Catalog Number:
AG0058SC
Chemical Name:
1,4-Dioxaspiro[4.4]nonane,2-butyl-
CAS Number:
78649-62-4
Molecular Formula:
C11H20O2
Molecular Weight:
184.2753
IUPAC Name:
3-butyl-1,4-dioxaspiro[4.4]nonane
InChI:
InChI=1S/C11H20O2/c1-2-3-6-10-9-12-11(13-10)7-4-5-8-11/h10H,2-9H2,1H3
InChI Key:
RZZUCKICOCVJJN-UHFFFAOYSA-N
SMILES:
CCCCC1COC2(O1)CCCC2
EC Number:
278-963-3
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.146g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.279g/mol
Monoisotopic Mass:
184.146g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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