1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol

C15H26O — CID 557551

IUPAC1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol
SMILESCC1=CCC(C)(C)C=CCC(C)(O)CCC1
InChIInChI=1S/C15H26O/c1-13-7-5-10-15(4,16)11-6-9-14(2,3)12-8-13/h6,8-9,16H,5,7,10-12H2,1-4H3
InChIKeyZLMAVMBYWKVCLV-UHFFFAOYSA-N
MW222.37 g/mol
LogP4.23
Rot. Bonds

About 1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol

1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol (PubChem CID 557551) has the molecular formula C15H26O and a molecular weight of 222.37 g/mol. Its IUPAC name is 1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol.

Molecular Properties

Compound Name1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol
PubChem CID557551
Molecular FormulaC15H26O
Molecular Weight222.37 g/mol
Exact Mass222.20
IUPAC Name1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol
SMILESCC1=CCC(C)(C)C=CCC(C)(O)CCC1
InChIInChI=1S/C15H26O/c1-13-7-5-10-15(4,16)11-6-9-14(2,3)12-8-13/h6,8-9,16H,5,7,10-12H2,1-4H3
InChIKeyZLMAVMBYWKVCLV-UHFFFAOYSA-N
XLogP4.23
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 ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol?
The IUPAC name of 1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol (CID 557551) is 1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol.
What is the SMILES notation for 1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol?
The canonical SMILES for 1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol is CC1=CCC(C)(C)C=CCC(C)(O)CCC1.
What is the InChIKey of 1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol?
The InChIKey is ZLMAVMBYWKVCLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26O/c1-13-7-5-10-15(4,16)11-6-9-14(2,3)12-8-13/h6,8-9,16H,5,7,10-12H2,1-4H3.
What are the key properties of 1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol?
1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol has a molecular weight of 222.37 g/mol, XLogP of 4.23, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol is sourced from PubChem (CID 557551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).