(5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol

C13H24O2 — CID 175902392

IUPAC(5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol
SMILESCC1CC[C@@]2(O1)C(C)(C)CCC[C@@]2(C)O
InChIInChI=1S/C13H24O2/c1-10-6-9-13(15-10)11(2,3)7-5-8-12(13,4)14/h10,14H,5-9H2,1-4H3/t10?,12-,13-/m1/s1
InChIKeyLJOISVFAMDWVFA-SKVSWLLESA-N
MW212.33 g/mol
LogP2.89
Rot. Bonds

About (5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol

(5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol (PubChem CID 175902392) has the molecular formula C13H24O2 and a molecular weight of 212.33 g/mol. Its IUPAC name is (5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol.

Molecular Properties

Compound Name(5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol
PubChem CID175902392
Molecular FormulaC13H24O2
Molecular Weight212.33 g/mol
Exact Mass212.18
IUPAC Name(5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol
SMILESCC1CC[C@@]2(O1)C(C)(C)CCC[C@@]2(C)O
InChIInChI=1S/C13H24O2/c1-10-6-9-13(15-10)11(2,3)7-5-8-12(13,4)14/h10,14H,5-9H2,1-4H3/t10?,12-,13-/m1/s1
InChIKeyLJOISVFAMDWVFA-SKVSWLLESA-N
XLogP2.89
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.33
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol?
The IUPAC name of (5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol (CID 175902392) is (5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol.
What is the SMILES notation for (5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol?
The canonical SMILES for (5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol is CC1CC[C@@]2(O1)C(C)(C)CCC[C@@]2(C)O.
What is the InChIKey of (5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol?
The InChIKey is LJOISVFAMDWVFA-SKVSWLLESA-N. The full InChI is InChI=1S/C13H24O2/c1-10-6-9-13(15-10)11(2,3)7-5-8-12(13,4)14/h10,14H,5-9H2,1-4H3/t10?,12-,13-/m1/s1.
What are the key properties of (5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol?
(5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol has a molecular weight of 212.33 g/mol, XLogP of 2.89, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R,6R)-2,6,10,10-tetramethyl-1-oxaspiro[4.5]decan-6-ol is sourced from PubChem (CID 175902392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).