8-bicyclo[3.2.1]octanylmethanol

C9H16O — CID 115011380

IUPAC8-bicyclo[3.2.1]octanylmethanol
SMILESOCC1C2CCCC1CC2
InChIInChI=1S/C9H16O/c10-6-9-7-2-1-3-8(9)5-4-7/h7-10H,1-6H2
InChIKeyUMSQSDWZHQDSLU-UHFFFAOYSA-N
MW140.23 g/mol
LogP1.80
Rot. Bonds1

About 8-bicyclo[3.2.1]octanylmethanol

8-bicyclo[3.2.1]octanylmethanol (PubChem CID 115011380) has the molecular formula C9H16O and a molecular weight of 140.23 g/mol. Its IUPAC name is 8-bicyclo[3.2.1]octanylmethanol.

Molecular Properties

Compound Name8-bicyclo[3.2.1]octanylmethanol
PubChem CID115011380
Molecular FormulaC9H16O
Molecular Weight140.23 g/mol
Exact Mass140.12
IUPAC Name8-bicyclo[3.2.1]octanylmethanol
SMILESOCC1C2CCCC1CC2
InChIInChI=1S/C9H16O/c10-6-9-7-2-1-3-8(9)5-4-7/h7-10H,1-6H2
InChIKeyUMSQSDWZHQDSLU-UHFFFAOYSA-N
XLogP1.80
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 8-bicyclo[3.2.1]octanylmethanol?
The IUPAC name of 8-bicyclo[3.2.1]octanylmethanol (CID 115011380) is 8-bicyclo[3.2.1]octanylmethanol.
What is the SMILES notation for 8-bicyclo[3.2.1]octanylmethanol?
The canonical SMILES for 8-bicyclo[3.2.1]octanylmethanol is OCC1C2CCCC1CC2.
What is the InChIKey of 8-bicyclo[3.2.1]octanylmethanol?
The InChIKey is UMSQSDWZHQDSLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O/c10-6-9-7-2-1-3-8(9)5-4-7/h7-10H,1-6H2.
What are the key properties of 8-bicyclo[3.2.1]octanylmethanol?
8-bicyclo[3.2.1]octanylmethanol has a molecular weight of 140.23 g/mol, XLogP of 1.80, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bicyclo[3.2.1]octanylmethanol is sourced from PubChem (CID 115011380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).