[(1R,4Z,8E,10R)-8,11,11-trimethyl-4-bicyclo[8.1.0]undeca-4,8-dienyl]methanol

C15H24O — CID 162648692

IUPAC[(1R,4Z,8E,10R)-8,11,11-trimethyl-4-bicyclo[8.1.0]undeca-4,8-dienyl]methanol
SMILESC/C1=C\[C@@H]2[C@@H](CC/C(CO)=C/CC1)C2(C)C
InChIInChI=1S/C15H24O/c1-11-5-4-6-12(10-16)7-8-13-14(9-11)15(13,2)3/h6,9,13-14,16H,4-5,7-8,10H2,1-3H3/b11-9+,12-6-/t13-,14-/m1/s1
InChIKeyUEYOECMJUKCPLC-VAYGVGCUSA-N
MW220.36 g/mol
LogP3.70
Rot. Bonds1

About [(1R,4Z,8E,10R)-8,11,11-trimethyl-4-bicyclo[8.1.0]undeca-4,8-dienyl]methanol

[(1R,4Z,8E,10R)-8,11,11-trimethyl-4-bicyclo[8.1.0]undeca-4,8-dienyl]methanol (PubChem CID 162648692) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is [(1R,4Z,8E,10R)-8,11,11-trimethyl-4-bicyclo[8.1.0]undeca-4,8-dienyl]methanol.

Molecular Properties

Compound Name[(1R,4Z,8E,10R)-8,11,11-trimethyl-4-bicyclo[8.1.0]undeca-4,8-dienyl]methanol
PubChem CID162648692
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name[(1R,4Z,8E,10R)-8,11,11-trimethyl-4-bicyclo[8.1.0]undeca-4,8-dienyl]methanol
SMILESC/C1=C\[C@@H]2[C@@H](CC/C(CO)=C/CC1)C2(C)C
InChIInChI=1S/C15H24O/c1-11-5-4-6-12(10-16)7-8-13-14(9-11)15(13,2)3/h6,9,13-14,16H,4-5,7-8,10H2,1-3H3/b11-9+,12-6-/t13-,14-/m1/s1
InChIKeyUEYOECMJUKCPLC-VAYGVGCUSA-N
XLogP3.70
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.70
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 [(1R,4Z,8E,10R)-8,11,11-trimethyl-4-bicyclo[8.1.0]undeca-4,8-dienyl]methanol?
The IUPAC name of [(1R,4Z,8E,10R)-8,11,11-trimethyl-4-bicyclo[8.1.0]undeca-4,8-dienyl]methanol (CID 162648692) is [(1R,4Z,8E,10R)-8,11,11-trimethyl-4-bicyclo[8.1.0]undeca-4,8-dienyl]methanol.
What is the SMILES notation for [(1R,4Z,8E,10R)-8,11,11-trimethyl-4-bicyclo[8.1.0]undeca-4,8-dienyl]methanol?
The canonical SMILES for [(1R,4Z,8E,10R)-8,11,11-trimethyl-4-bicyclo[8.1.0]undeca-4,8-dienyl]methanol is C/C1=C\[C@@H]2[C@@H](CC/C(CO)=C/CC1)C2(C)C.
What is the InChIKey of [(1R,4Z,8E,10R)-8,11,11-trimethyl-4-bicyclo[8.1.0]undeca-4,8-dienyl]methanol?
The InChIKey is UEYOECMJUKCPLC-VAYGVGCUSA-N. The full InChI is InChI=1S/C15H24O/c1-11-5-4-6-12(10-16)7-8-13-14(9-11)15(13,2)3/h6,9,13-14,16H,4-5,7-8,10H2,1-3H3/b11-9+,12-6-/t13-,14-/m1/s1.
What are the key properties of [(1R,4Z,8E,10R)-8,11,11-trimethyl-4-bicyclo[8.1.0]undeca-4,8-dienyl]methanol?
[(1R,4Z,8E,10R)-8,11,11-trimethyl-4-bicyclo[8.1.0]undeca-4,8-dienyl]methanol has a molecular weight of 220.36 g/mol, XLogP of 3.70, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,4Z,8E,10R)-8,11,11-trimethyl-4-bicyclo[8.1.0]undeca-4,8-dienyl]methanol is sourced from PubChem (CID 162648692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).