spiro[4.5]decan-4-ol;dihydrochloride

C10H20Cl2O — CID 141041320

IUPACspiro[4.5]decan-4-ol;dihydrochloride
SMILESCl.Cl.OC1CCCC12CCCCC2
InChIInChI=1S/C10H18O.2ClH/c11-9-5-4-8-10(9)6-2-1-3-7-10;;/h9,11H,1-8H2;2*1H
InChIKeyUXPSDZCHJHKSLF-UHFFFAOYSA-N
MW227.17 g/mol
LogP3.33
Rot. Bonds

About spiro[4.5]decan-4-ol;dihydrochloride

spiro[4.5]decan-4-ol;dihydrochloride (PubChem CID 141041320) has the molecular formula C10H20Cl2O and a molecular weight of 227.17 g/mol. Its IUPAC name is spiro[4.5]decan-4-ol;dihydrochloride.

Molecular Properties

Compound Namespiro[4.5]decan-4-ol;dihydrochloride
PubChem CID141041320
Molecular FormulaC10H20Cl2O
Molecular Weight227.17 g/mol
Exact Mass226.09
IUPAC Namespiro[4.5]decan-4-ol;dihydrochloride
SMILESCl.Cl.OC1CCCC12CCCCC2
InChIInChI=1S/C10H18O.2ClH/c11-9-5-4-8-10(9)6-2-1-3-7-10;;/h9,11H,1-8H2;2*1H
InChIKeyUXPSDZCHJHKSLF-UHFFFAOYSA-N
XLogP3.33
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.17
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(4S,5R,12R)-spiro[4.7]dodecane-4,12-diol
CID 11127251
2-oxaspiro[3.4]octan-5-ol
CID 178199967
2-azaspiro[3.5]nonan-5-ol
CID 167738706
(4S,5R,10R)-spiro[4.5]decane-4,10-diol
CID 14934378
(4S,5R)-spiro[4.5]decane-4,10-diol
CID 135069767
2-oxaspiro[5.6]dodecan-5-ol
CID 82406501
spiro[4.5]dec-8-en-4-ol
CID 130126404
(5R,11S)-spiro[5.5]undecane-5,11-diol
CID 10997722
7-thiaspiro[4.5]decan-10-ol
CID 82411755
6-azaspiro[3.5]nonan-9-ol
CID 82418041
spiro[3.5]nonane-3,7-diol
CID 139886993
cyclopentane-1,1,2-triol
CID 19830380

Frequently Asked Questions

What is the IUPAC name of spiro[4.5]decan-4-ol;dihydrochloride?
The IUPAC name of spiro[4.5]decan-4-ol;dihydrochloride (CID 141041320) is spiro[4.5]decan-4-ol;dihydrochloride.
What is the SMILES notation for spiro[4.5]decan-4-ol;dihydrochloride?
The canonical SMILES for spiro[4.5]decan-4-ol;dihydrochloride is Cl.Cl.OC1CCCC12CCCCC2.
What is the InChIKey of spiro[4.5]decan-4-ol;dihydrochloride?
The InChIKey is UXPSDZCHJHKSLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O.2ClH/c11-9-5-4-8-10(9)6-2-1-3-7-10;;/h9,11H,1-8H2;2*1H.
What are the key properties of spiro[4.5]decan-4-ol;dihydrochloride?
spiro[4.5]decan-4-ol;dihydrochloride has a molecular weight of 227.17 g/mol, XLogP of 3.33, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[4.5]decan-4-ol;dihydrochloride is sourced from PubChem (CID 141041320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).