(2Z,8E)-3,7,7,10-tetramethylcycloundeca-2,8-dien-1-ol

C15H26O — CID 5353015

IUPAC(2Z,8E)-3,7,7,10-tetramethylcycloundeca-2,8-dien-1-ol
SMILESC/C1=C/C(O)CC(C)/C=C/C(C)(C)CCC1
InChIInChI=1S/C15H26O/c1-12-6-5-8-15(3,4)9-7-13(2)11-14(16)10-12/h7,9-10,13-14,16H,5-6,8,11H2,1-4H3/b9-7+,12-10-
InChIKeyOLKBYNHEDMHHQA-IOIMVZBSSA-N
MW222.37 g/mol
LogP4.09
Rot. Bonds

About (2Z,8E)-3,7,7,10-tetramethylcycloundeca-2,8-dien-1-ol

(2Z,8E)-3,7,7,10-tetramethylcycloundeca-2,8-dien-1-ol (PubChem CID 5353015) has the molecular formula C15H26O and a molecular weight of 222.37 g/mol. Its IUPAC name is (2Z,8E)-3,7,7,10-tetramethylcycloundeca-2,8-dien-1-ol.

Molecular Properties

Compound Name(2Z,8E)-3,7,7,10-tetramethylcycloundeca-2,8-dien-1-ol
PubChem CID5353015
Molecular FormulaC15H26O
Molecular Weight222.37 g/mol
Exact Mass222.20
IUPAC Name(2Z,8E)-3,7,7,10-tetramethylcycloundeca-2,8-dien-1-ol
SMILESC/C1=C/C(O)CC(C)/C=C/C(C)(C)CCC1
InChIInChI=1S/C15H26O/c1-12-6-5-8-15(3,4)9-7-13(2)11-14(16)10-12/h7,9-10,13-14,16H,5-6,8,11H2,1-4H3/b9-7+,12-10-
InChIKeyOLKBYNHEDMHHQA-IOIMVZBSSA-N
XLogP4.09
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 ≤ 54.09
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 (2Z,8E)-3,7,7,10-tetramethylcycloundeca-2,8-dien-1-ol?
The IUPAC name of (2Z,8E)-3,7,7,10-tetramethylcycloundeca-2,8-dien-1-ol (CID 5353015) is (2Z,8E)-3,7,7,10-tetramethylcycloundeca-2,8-dien-1-ol.
What is the SMILES notation for (2Z,8E)-3,7,7,10-tetramethylcycloundeca-2,8-dien-1-ol?
The canonical SMILES for (2Z,8E)-3,7,7,10-tetramethylcycloundeca-2,8-dien-1-ol is C/C1=C/C(O)CC(C)/C=C/C(C)(C)CCC1.
What is the InChIKey of (2Z,8E)-3,7,7,10-tetramethylcycloundeca-2,8-dien-1-ol?
The InChIKey is OLKBYNHEDMHHQA-IOIMVZBSSA-N. The full InChI is InChI=1S/C15H26O/c1-12-6-5-8-15(3,4)9-7-13(2)11-14(16)10-12/h7,9-10,13-14,16H,5-6,8,11H2,1-4H3/b9-7+,12-10-.
What are the key properties of (2Z,8E)-3,7,7,10-tetramethylcycloundeca-2,8-dien-1-ol?
(2Z,8E)-3,7,7,10-tetramethylcycloundeca-2,8-dien-1-ol has a molecular weight of 222.37 g/mol, XLogP of 4.09, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,8E)-3,7,7,10-tetramethylcycloundeca-2,8-dien-1-ol is sourced from PubChem (CID 5353015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).