3,3,9,10-tetramethyltricyclo[7.1.1.02,7]undecan-8-ol

C15H26O — CID 70531905

IUPAC3,3,9,10-tetramethyltricyclo[7.1.1.02,7]undecan-8-ol
SMILESCC1C2CC1(C)C(O)C1CCCC(C)(C)C21
InChIInChI=1S/C15H26O/c1-9-11-8-15(9,4)13(16)10-6-5-7-14(2,3)12(10)11/h9-13,16H,5-8H2,1-4H3
InChIKeyWMCUFQNUMZJONI-UHFFFAOYSA-N
MW222.37 g/mol
LogP3.47
Rot. Bonds

About 3,3,9,10-tetramethyltricyclo[7.1.1.02,7]undecan-8-ol

3,3,9,10-tetramethyltricyclo[7.1.1.02,7]undecan-8-ol (PubChem CID 70531905) has the molecular formula C15H26O and a molecular weight of 222.37 g/mol. Its IUPAC name is 3,3,9,10-tetramethyltricyclo[7.1.1.02,7]undecan-8-ol.

Molecular Properties

Compound Name3,3,9,10-tetramethyltricyclo[7.1.1.02,7]undecan-8-ol
PubChem CID70531905
Molecular FormulaC15H26O
Molecular Weight222.37 g/mol
Exact Mass222.20
IUPAC Name3,3,9,10-tetramethyltricyclo[7.1.1.02,7]undecan-8-ol
SMILESCC1C2CC1(C)C(O)C1CCCC(C)(C)C21
InChIInChI=1S/C15H26O/c1-9-11-8-15(9,4)13(16)10-6-5-7-14(2,3)12(10)11/h9-13,16H,5-8H2,1-4H3
InChIKeyWMCUFQNUMZJONI-UHFFFAOYSA-N
XLogP3.47
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.37
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3,3,9,10-tetramethyltricyclo[7.1.1.02,7]undecan-8-ol?
The IUPAC name of 3,3,9,10-tetramethyltricyclo[7.1.1.02,7]undecan-8-ol (CID 70531905) is 3,3,9,10-tetramethyltricyclo[7.1.1.02,7]undecan-8-ol.
What is the SMILES notation for 3,3,9,10-tetramethyltricyclo[7.1.1.02,7]undecan-8-ol?
The canonical SMILES for 3,3,9,10-tetramethyltricyclo[7.1.1.02,7]undecan-8-ol is CC1C2CC1(C)C(O)C1CCCC(C)(C)C21.
What is the InChIKey of 3,3,9,10-tetramethyltricyclo[7.1.1.02,7]undecan-8-ol?
The InChIKey is WMCUFQNUMZJONI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26O/c1-9-11-8-15(9,4)13(16)10-6-5-7-14(2,3)12(10)11/h9-13,16H,5-8H2,1-4H3.
What are the key properties of 3,3,9,10-tetramethyltricyclo[7.1.1.02,7]undecan-8-ol?
3,3,9,10-tetramethyltricyclo[7.1.1.02,7]undecan-8-ol has a molecular weight of 222.37 g/mol, XLogP of 3.47, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,9,10-tetramethyltricyclo[7.1.1.02,7]undecan-8-ol is sourced from PubChem (CID 70531905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).