1,1,2-tricyclopropylethanol

C11H18O — CID 102391905

IUPAC1,1,2-tricyclopropylethanol
SMILESOC(CC1CC1)(C1CC1)C1CC1
InChIInChI=1S/C11H18O/c12-11(9-3-4-9,10-5-6-10)7-8-1-2-8/h8-10,12H,1-7H2
InChIKeyNTWBWGIBOCJMRW-UHFFFAOYSA-N
MW166.26 g/mol
LogP2.34
Rot. Bonds4

About 1,1,2-tricyclopropylethanol

1,1,2-tricyclopropylethanol (PubChem CID 102391905) has the molecular formula C11H18O and a molecular weight of 166.26 g/mol. Its IUPAC name is 1,1,2-tricyclopropylethanol.

Molecular Properties

Compound Name1,1,2-tricyclopropylethanol
PubChem CID102391905
Molecular FormulaC11H18O
Molecular Weight166.26 g/mol
Exact Mass166.14
IUPAC Name1,1,2-tricyclopropylethanol
SMILESOC(CC1CC1)(C1CC1)C1CC1
InChIInChI=1S/C11H18O/c12-11(9-3-4-9,10-5-6-10)7-8-1-2-8/h8-10,12H,1-7H2
InChIKeyNTWBWGIBOCJMRW-UHFFFAOYSA-N
XLogP2.34
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.26
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,1,2-tricyclopropylethanol?
The IUPAC name of 1,1,2-tricyclopropylethanol (CID 102391905) is 1,1,2-tricyclopropylethanol.
What is the SMILES notation for 1,1,2-tricyclopropylethanol?
The canonical SMILES for 1,1,2-tricyclopropylethanol is OC(CC1CC1)(C1CC1)C1CC1.
What is the InChIKey of 1,1,2-tricyclopropylethanol?
The InChIKey is NTWBWGIBOCJMRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18O/c12-11(9-3-4-9,10-5-6-10)7-8-1-2-8/h8-10,12H,1-7H2.
What are the key properties of 1,1,2-tricyclopropylethanol?
1,1,2-tricyclopropylethanol has a molecular weight of 166.26 g/mol, XLogP of 2.34, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2-tricyclopropylethanol is sourced from PubChem (CID 102391905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).