(1R,3E,7E)-1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol

C15H26O — CID 162927555

IUPAC(1R,3E,7E)-1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol
SMILESC/C1=C\CC(C)(C)/C=C/C[C@](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/b9-6+,13-8+/t15-/m1/s1
InChIKeyZLMAVMBYWKVCLV-AWSSCCJBSA-N
MW222.37 g/mol
LogP4.23
Rot. Bonds

About (1R,3E,7E)-1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol

(1R,3E,7E)-1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol (PubChem CID 162927555) has the molecular formula C15H26O and a molecular weight of 222.37 g/mol. Its IUPAC name is (1R,3E,7E)-1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol.

Molecular Properties

Compound Name(1R,3E,7E)-1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol
PubChem CID162927555
Molecular FormulaC15H26O
Molecular Weight222.37 g/mol
Exact Mass222.20
IUPAC Name(1R,3E,7E)-1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol
SMILESC/C1=C\CC(C)(C)/C=C/C[C@](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/b9-6+,13-8+/t15-/m1/s1
InChIKeyZLMAVMBYWKVCLV-AWSSCCJBSA-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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Related Compounds

(1R,2S,4Z,8E)-2,6,6,9-tetramethylcycloundeca-4,8-diene-1,2-diol
CID 177497934
(4Z)-1,5-dimethylcyclooct-4-en-1-ol
CID 14267333
(1E,5E)-1,4,4-trimethyl-8-methylidenecycloundeca-1,5-diene;(5E)-1,4,4-trimethyl-8-methylidenecycloundeca-1,5-diene
CID 160681268
(1Z,4Z,8E)-2,6,6,9-tetramethylcycloundeca-1,4,8-triene
CID 24798693
(1Z,4Z,7Z)-1,5,9,9-tetramethylcyclotrideca-1,4,7-triene
CID 175103476
1,4-dimethylcyclooct-4-en-1-ol
CID 68739487
5,5,8-trimethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene-1-carbaldehyde
CID 162992711
5,8,8-trimethylcycloundeca-1,5,9-triene-1-carboxylic acid
CID 74202895
1,5-dimethylcyclohepta-2,5-dien-1-ol
CID 143034749
(1Z,4Z,8Z)-5,9,12,12-tetramethylcyclododeca-1,4,8-triene
CID 140996280
1,5,9-trimethylspiro[5.5]undeca-3,9-dien-5-ol
CID 135017310
4,4,7-trimethylcycloundeca-2,6,10-trien-1-one
CID 74348357

Frequently Asked Questions

What is the IUPAC name of (1R,3E,7E)-1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol?
The IUPAC name of (1R,3E,7E)-1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol (CID 162927555) is (1R,3E,7E)-1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol.
What is the SMILES notation for (1R,3E,7E)-1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol?
The canonical SMILES for (1R,3E,7E)-1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol is C/C1=C\CC(C)(C)/C=C/C[C@](C)(O)CCC1.
What is the InChIKey of (1R,3E,7E)-1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol?
The InChIKey is ZLMAVMBYWKVCLV-AWSSCCJBSA-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/b9-6+,13-8+/t15-/m1/s1.
What are the key properties of (1R,3E,7E)-1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol?
(1R,3E,7E)-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 (1R,3E,7E)-1,5,5,8-tetramethylcycloundeca-3,7-dien-1-ol is sourced from PubChem (CID 162927555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).