cycloundecane-1,2-diol

C11H22O2 — CID 67185134

IUPACcycloundecane-1,2-diol
SMILESOC1CCCCCCCCCC1O
InChIInChI=1S/C11H22O2/c12-10-8-6-4-2-1-3-5-7-9-11(10)13/h10-13H,1-9H2
InChIKeyDBNMQSKHXFTFBV-UHFFFAOYSA-N
MW186.29 g/mol
LogP2.23
Rot. Bonds

About cycloundecane-1,2-diol

cycloundecane-1,2-diol (PubChem CID 67185134) has the molecular formula C11H22O2 and a molecular weight of 186.29 g/mol. Its IUPAC name is cycloundecane-1,2-diol.

Molecular Properties

Compound Namecycloundecane-1,2-diol
PubChem CID67185134
Molecular FormulaC11H22O2
Molecular Weight186.29 g/mol
Exact Mass186.16
IUPAC Namecycloundecane-1,2-diol
SMILESOC1CCCCCCCCCC1O
InChIInChI=1S/C11H22O2/c12-10-8-6-4-2-1-3-5-7-9-11(10)13/h10-13H,1-9H2
InChIKeyDBNMQSKHXFTFBV-UHFFFAOYSA-N
XLogP2.23
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.29
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cycloundecane-1,2-diol?
The IUPAC name of cycloundecane-1,2-diol (CID 67185134) is cycloundecane-1,2-diol.
What is the SMILES notation for cycloundecane-1,2-diol?
The canonical SMILES for cycloundecane-1,2-diol is OC1CCCCCCCCCC1O.
What is the InChIKey of cycloundecane-1,2-diol?
The InChIKey is DBNMQSKHXFTFBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O2/c12-10-8-6-4-2-1-3-5-7-9-11(10)13/h10-13H,1-9H2.
What are the key properties of cycloundecane-1,2-diol?
cycloundecane-1,2-diol has a molecular weight of 186.29 g/mol, XLogP of 2.23, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cycloundecane-1,2-diol is sourced from PubChem (CID 67185134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).