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Home > Other Heterocycles > 714-88-5
714-88-5 | 1,5-Dioxaspiro[5.5]undecane-3,3-dimethanol
CAS No: 714-88-5 Catalog No: AG005HPJ MDL No:
Product Description
Catalog Number:
AG005HPJ
Chemical Name:
1,5-Dioxaspiro[5.5]undecane-3,3-dimethanol
CAS Number:
714-88-5
Molecular Formula:
C11H20O4
Molecular Weight:
216.2741
IUPAC Name:
[3-(hydroxymethyl)-1,5-dioxaspiro[5.5]undecan-3-yl]methanol
InChI:
InChI=1S/C11H20O4/c12-6-10(7-13)8-14-11(15-9-10)4-2-1-3-5-11/h12-13H,1-9H2
InChI Key:
SYPPEVGMCKUVTR-UHFFFAOYSA-N
SMILES:
OCC1(CO)COC2(OC1)CCCCC2
NSC Number:
157417
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.136g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
216.277g/mol
Monoisotopic Mass:
216.136g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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