(8S)-4-oxadispiro[2.1.25.23]nonan-8-ol

C8H12O2 — CID 163559597

IUPAC(8S)-4-oxadispiro[2.1.25.23]nonan-8-ol
SMILESO[C@H]1CC2(CC2)OC12CC2
InChIInChI=1S/C8H12O2/c9-6-5-7(1-2-7)10-8(6)3-4-8/h6,9H,1-5H2/t6-/m0/s1
InChIKeyFQBQTSCTYHGUAQ-LURJTMIESA-N
MW140.18 g/mol
LogP0.83
Rot. Bonds

About (8S)-4-oxadispiro[2.1.25.23]nonan-8-ol

(8S)-4-oxadispiro[2.1.25.23]nonan-8-ol (PubChem CID 163559597) has the molecular formula C8H12O2 and a molecular weight of 140.18 g/mol. Its IUPAC name is (8S)-4-oxadispiro[2.1.25.23]nonan-8-ol.

Molecular Properties

Compound Name(8S)-4-oxadispiro[2.1.25.23]nonan-8-ol
PubChem CID163559597
Molecular FormulaC8H12O2
Molecular Weight140.18 g/mol
Exact Mass140.08
IUPAC Name(8S)-4-oxadispiro[2.1.25.23]nonan-8-ol
SMILESO[C@H]1CC2(CC2)OC12CC2
InChIInChI=1S/C8H12O2/c9-6-5-7(1-2-7)10-8(6)3-4-8/h6,9H,1-5H2/t6-/m0/s1
InChIKeyFQBQTSCTYHGUAQ-LURJTMIESA-N
XLogP0.83
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.18
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(8R,9R)-4-oxadispiro[2.1.25.33]decane-6,8,9-triol
CID 163554872
9-methyl-8-oxadispiro[2.1.25.33]decan-6-ol
CID 163678710
(5S,6S)-6-methoxy-4-oxadispiro[2.1.25.33]decane
CID 163836885
2,2-dimethyl-8-propan-2-yl-1-oxaspiro[4.5]decan-6-ol
CID 12527840
2,7-dimethyl-1,8-dioxaspiro[4.5]decane-2-carboxylic acid
CID 130585344
(8S,9R,11S)-7-oxatrispiro[2.0.24.1.28.13]undecane-9,11-diol
CID 163723091
(1S,6R)-10-oxatricyclo[4.3.1.01,6]decan-8-ol
CID 130622309
2,2-dichlorocyclopropan-1-ol
CID 13351707
CID 142437651
CID 142437651
(1S,5R,9S)-12-oxatricyclo[7.2.1.01,5]dodecan-9-ol
CID 15833764
1-(1,3-dihydroxycyclopentyl)cyclopentane-1,2-diol
CID 90694398
(3S)-1-oxaspiro[4.4]nonan-3-ol
CID 124707938

Frequently Asked Questions

What is the IUPAC name of (8S)-4-oxadispiro[2.1.25.23]nonan-8-ol?
The IUPAC name of (8S)-4-oxadispiro[2.1.25.23]nonan-8-ol (CID 163559597) is (8S)-4-oxadispiro[2.1.25.23]nonan-8-ol.
What is the SMILES notation for (8S)-4-oxadispiro[2.1.25.23]nonan-8-ol?
The canonical SMILES for (8S)-4-oxadispiro[2.1.25.23]nonan-8-ol is O[C@H]1CC2(CC2)OC12CC2.
What is the InChIKey of (8S)-4-oxadispiro[2.1.25.23]nonan-8-ol?
The InChIKey is FQBQTSCTYHGUAQ-LURJTMIESA-N. The full InChI is InChI=1S/C8H12O2/c9-6-5-7(1-2-7)10-8(6)3-4-8/h6,9H,1-5H2/t6-/m0/s1.
What are the key properties of (8S)-4-oxadispiro[2.1.25.23]nonan-8-ol?
(8S)-4-oxadispiro[2.1.25.23]nonan-8-ol has a molecular weight of 140.18 g/mol, XLogP of 0.83, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (8S)-4-oxadispiro[2.1.25.23]nonan-8-ol is sourced from PubChem (CID 163559597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).