3-tricyclo[3.1.0.02,6]hexanylmethanol

C7H10O — CID 85316389

IUPAC3-tricyclo[3.1.0.02,6]hexanylmethanol
SMILESOCC1CC2C3C1C23
InChIInChI=1S/C7H10O/c8-2-3-1-4-6-5(3)7(4)6/h3-8H,1-2H2
InChIKeyXNNYUKDOCRXUSZ-UHFFFAOYSA-N
MW110.16 g/mol
LogP0.49
Rot. Bonds1

About 3-tricyclo[3.1.0.02,6]hexanylmethanol

3-tricyclo[3.1.0.02,6]hexanylmethanol (PubChem CID 85316389) has the molecular formula C7H10O and a molecular weight of 110.16 g/mol. Its IUPAC name is 3-tricyclo[3.1.0.02,6]hexanylmethanol.

Molecular Properties

Compound Name3-tricyclo[3.1.0.02,6]hexanylmethanol
PubChem CID85316389
Molecular FormulaC7H10O
Molecular Weight110.16 g/mol
Exact Mass110.07
IUPAC Name3-tricyclo[3.1.0.02,6]hexanylmethanol
SMILESOCC1CC2C3C1C23
InChIInChI=1S/C7H10O/c8-2-3-1-4-6-5(3)7(4)6/h3-8H,1-2H2
InChIKeyXNNYUKDOCRXUSZ-UHFFFAOYSA-N
XLogP0.49
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 3-tricyclo[3.1.0.02,6]hexanylmethanol?
The IUPAC name of 3-tricyclo[3.1.0.02,6]hexanylmethanol (CID 85316389) is 3-tricyclo[3.1.0.02,6]hexanylmethanol.
What is the SMILES notation for 3-tricyclo[3.1.0.02,6]hexanylmethanol?
The canonical SMILES for 3-tricyclo[3.1.0.02,6]hexanylmethanol is OCC1CC2C3C1C23.
What is the InChIKey of 3-tricyclo[3.1.0.02,6]hexanylmethanol?
The InChIKey is XNNYUKDOCRXUSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10O/c8-2-3-1-4-6-5(3)7(4)6/h3-8H,1-2H2.
What are the key properties of 3-tricyclo[3.1.0.02,6]hexanylmethanol?
3-tricyclo[3.1.0.02,6]hexanylmethanol has a molecular weight of 110.16 g/mol, XLogP of 0.49, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tricyclo[3.1.0.02,6]hexanylmethanol is sourced from PubChem (CID 85316389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).