8,8-difluorospiro[4.5]decane-1,4-diol

C10H16F2O2 — CID 141269140

IUPAC8,8-difluorospiro[4.5]decane-1,4-diol
SMILESOC1CCC(O)C12CCC(F)(F)CC2
InChIInChI=1S/C10H16F2O2/c11-10(12)5-3-9(4-6-10)7(13)1-2-8(9)14/h7-8,13-14H,1-6H2
InChIKeyUUJRKHYCDVDAJL-UHFFFAOYSA-N
MW206.23 g/mol
LogP1.70
Rot. Bonds

About 8,8-difluorospiro[4.5]decane-1,4-diol

8,8-difluorospiro[4.5]decane-1,4-diol (PubChem CID 141269140) has the molecular formula C10H16F2O2 and a molecular weight of 206.23 g/mol. Its IUPAC name is 8,8-difluorospiro[4.5]decane-1,4-diol.

Molecular Properties

Compound Name8,8-difluorospiro[4.5]decane-1,4-diol
PubChem CID141269140
Molecular FormulaC10H16F2O2
Molecular Weight206.23 g/mol
Exact Mass206.11
IUPAC Name8,8-difluorospiro[4.5]decane-1,4-diol
SMILESOC1CCC(O)C12CCC(F)(F)CC2
InChIInChI=1S/C10H16F2O2/c11-10(12)5-3-9(4-6-10)7(13)1-2-8(9)14/h7-8,13-14H,1-6H2
InChIKeyUUJRKHYCDVDAJL-UHFFFAOYSA-N
XLogP1.70
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.23
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8,8-difluorospiro[4.5]decane-1,4-diol?
The IUPAC name of 8,8-difluorospiro[4.5]decane-1,4-diol (CID 141269140) is 8,8-difluorospiro[4.5]decane-1,4-diol.
What is the SMILES notation for 8,8-difluorospiro[4.5]decane-1,4-diol?
The canonical SMILES for 8,8-difluorospiro[4.5]decane-1,4-diol is OC1CCC(O)C12CCC(F)(F)CC2.
What is the InChIKey of 8,8-difluorospiro[4.5]decane-1,4-diol?
The InChIKey is UUJRKHYCDVDAJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F2O2/c11-10(12)5-3-9(4-6-10)7(13)1-2-8(9)14/h7-8,13-14H,1-6H2.
What are the key properties of 8,8-difluorospiro[4.5]decane-1,4-diol?
8,8-difluorospiro[4.5]decane-1,4-diol has a molecular weight of 206.23 g/mol, XLogP of 1.70, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8,8-difluorospiro[4.5]decane-1,4-diol is sourced from PubChem (CID 141269140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).