[(1'R,5'R)-spiro[1,3-dioxolane-2,3'-tricyclo[3.3.0.02,8]octane]-1'-yl]methanol

C11H16O3 — CID 11063350

IUPAC[(1'R,5'R)-spiro[1,3-dioxolane-2,3'-tricyclo[3.3.0.02,8]octane]-1'-yl]methanol
SMILESOC[C@@]12C3CC[C@@H]1CC1(OCCO1)C32
InChIInChI=1S/C11H16O3/c12-6-10-7-1-2-8(10)9(10)11(5-7)13-3-4-14-11/h7-9,12H,1-6H2/t7-,8?,9?,10+/m1/s1
InChIKeyAZGJYTKHCOCVKF-WOOKNIGNSA-N
MW196.25 g/mol
LogP0.77
Rot. Bonds1

About [(1'R,5'R)-spiro[1,3-dioxolane-2,3'-tricyclo[3.3.0.02,8]octane]-1'-yl]methanol

[(1'R,5'R)-spiro[1,3-dioxolane-2,3'-tricyclo[3.3.0.02,8]octane]-1'-yl]methanol (PubChem CID 11063350) has the molecular formula C11H16O3 and a molecular weight of 196.25 g/mol. Its IUPAC name is [(1'R,5'R)-spiro[1,3-dioxolane-2,3'-tricyclo[3.3.0.02,8]octane]-1'-yl]methanol.

Molecular Properties

Compound Name[(1'R,5'R)-spiro[1,3-dioxolane-2,3'-tricyclo[3.3.0.02,8]octane]-1'-yl]methanol
PubChem CID11063350
Molecular FormulaC11H16O3
Molecular Weight196.25 g/mol
Exact Mass196.11
IUPAC Name[(1'R,5'R)-spiro[1,3-dioxolane-2,3'-tricyclo[3.3.0.02,8]octane]-1'-yl]methanol
SMILESOC[C@@]12C3CC[C@@H]1CC1(OCCO1)C32
InChIInChI=1S/C11H16O3/c12-6-10-7-1-2-8(10)9(10)11(5-7)13-3-4-14-11/h7-9,12H,1-6H2/t7-,8?,9?,10+/m1/s1
InChIKeyAZGJYTKHCOCVKF-WOOKNIGNSA-N
XLogP0.77
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [(1'R,5'R)-spiro[1,3-dioxolane-2,3'-tricyclo[3.3.0.02,8]octane]-1'-yl]methanol with MolForge

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Related Compounds

(1'R,2'S,4'R)-spiro[1,3-dioxolane-2,5'-bicyclo[2.2.2]octane]-2'-ol
CID 11593551
6-methyl-9-(2-methyloxiran-2-yl)-1,4-dioxaspiro[4.5]decane
CID 593229
(5S,8R,9S,10S,11R,13S,14R,17R)-13-(hydroxymethyl)-10-methyl-17-(2-methyl-1,3-dioxolan-2-yl)spiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]-11-ol
CID 11874458
CID 144797601
CID 144797601
2'-chlorospiro[1,3-dioxolane-2,5'-bicyclo[2.2.2]octane]-2'-carbonitrile
CID 134967360
(1'R,2'S,4'R,7'R)-spiro[1,3-dioxolane-2,8'-3-oxatricyclo[5.2.0.02,4]nonane]
CID 88603451
(1'R,5'R)-6'-chloro-6'-methylspiro[1,3-dioxolane-2,2'-bicyclo[3.1.0]hexane]
CID 57413279
(5S,8R,9R,10R,13R,14S,17S)-10,13-dimethylspiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]-17-ol
CID 7052586
1-[(2R,5S,8S,9R,10S,13R,14R,17S)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]spiro[1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,2'-1,3-dioxolane]-2-yl]ethanone
CID 124914354
(1'R,3'R,4'R)-2',2',3'-trimethylspiro[1,3-dioxolane-2,5'-bicyclo[2.2.1]heptane]
CID 51669756
CID 138698868
CID 138698868
(9R)-6-methyl-1,4-dioxaspiro[4.5]decane-9-carboxylic acid
CID 130642210

Frequently Asked Questions

What is the IUPAC name of [(1'R,5'R)-spiro[1,3-dioxolane-2,3'-tricyclo[3.3.0.02,8]octane]-1'-yl]methanol?
The IUPAC name of [(1'R,5'R)-spiro[1,3-dioxolane-2,3'-tricyclo[3.3.0.02,8]octane]-1'-yl]methanol (CID 11063350) is [(1'R,5'R)-spiro[1,3-dioxolane-2,3'-tricyclo[3.3.0.02,8]octane]-1'-yl]methanol.
What is the SMILES notation for [(1'R,5'R)-spiro[1,3-dioxolane-2,3'-tricyclo[3.3.0.02,8]octane]-1'-yl]methanol?
The canonical SMILES for [(1'R,5'R)-spiro[1,3-dioxolane-2,3'-tricyclo[3.3.0.02,8]octane]-1'-yl]methanol is OC[C@@]12C3CC[C@@H]1CC1(OCCO1)C32.
What is the InChIKey of [(1'R,5'R)-spiro[1,3-dioxolane-2,3'-tricyclo[3.3.0.02,8]octane]-1'-yl]methanol?
The InChIKey is AZGJYTKHCOCVKF-WOOKNIGNSA-N. The full InChI is InChI=1S/C11H16O3/c12-6-10-7-1-2-8(10)9(10)11(5-7)13-3-4-14-11/h7-9,12H,1-6H2/t7-,8?,9?,10+/m1/s1.
What are the key properties of [(1'R,5'R)-spiro[1,3-dioxolane-2,3'-tricyclo[3.3.0.02,8]octane]-1'-yl]methanol?
[(1'R,5'R)-spiro[1,3-dioxolane-2,3'-tricyclo[3.3.0.02,8]octane]-1'-yl]methanol has a molecular weight of 196.25 g/mol, XLogP of 0.77, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(1'R,5'R)-spiro[1,3-dioxolane-2,3'-tricyclo[3.3.0.02,8]octane]-1'-yl]methanol is sourced from PubChem (CID 11063350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).