(4R)-4,8-dimethylnon-7-en-4-ol

C11H22O — CID 90181485

IUPAC(4R)-4,8-dimethylnon-7-en-4-ol
SMILESCCC[C@@](C)(O)CCC=C(C)C
InChIInChI=1S/C11H22O/c1-5-8-11(4,12)9-6-7-10(2)3/h7,12H,5-6,8-9H2,1-4H3/t11-/m1/s1
InChIKeyGLLYSEVWEKSIEI-LLVKDONJSA-N
MW170.30 g/mol
LogP3.28
Rot. Bonds5

About (4R)-4,8-dimethylnon-7-en-4-ol

(4R)-4,8-dimethylnon-7-en-4-ol (PubChem CID 90181485) has the molecular formula C11H22O and a molecular weight of 170.30 g/mol. Its IUPAC name is (4R)-4,8-dimethylnon-7-en-4-ol.

Molecular Properties

Compound Name(4R)-4,8-dimethylnon-7-en-4-ol
PubChem CID90181485
Molecular FormulaC11H22O
Molecular Weight170.30 g/mol
Exact Mass170.17
IUPAC Name(4R)-4,8-dimethylnon-7-en-4-ol
SMILESCCC[C@@](C)(O)CCC=C(C)C
InChIInChI=1S/C11H22O/c1-5-8-11(4,12)9-6-7-10(2)3/h7,12H,5-6,8-9H2,1-4H3/t11-/m1/s1
InChIKeyGLLYSEVWEKSIEI-LLVKDONJSA-N
XLogP3.28
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 53.28
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 (4R)-4,8-dimethylnon-7-en-4-ol?
The IUPAC name of (4R)-4,8-dimethylnon-7-en-4-ol (CID 90181485) is (4R)-4,8-dimethylnon-7-en-4-ol.
What is the SMILES notation for (4R)-4,8-dimethylnon-7-en-4-ol?
The canonical SMILES for (4R)-4,8-dimethylnon-7-en-4-ol is CCC[C@@](C)(O)CCC=C(C)C.
What is the InChIKey of (4R)-4,8-dimethylnon-7-en-4-ol?
The InChIKey is GLLYSEVWEKSIEI-LLVKDONJSA-N. The full InChI is InChI=1S/C11H22O/c1-5-8-11(4,12)9-6-7-10(2)3/h7,12H,5-6,8-9H2,1-4H3/t11-/m1/s1.
What are the key properties of (4R)-4,8-dimethylnon-7-en-4-ol?
(4R)-4,8-dimethylnon-7-en-4-ol has a molecular weight of 170.30 g/mol, XLogP of 3.28, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4,8-dimethylnon-7-en-4-ol is sourced from PubChem (CID 90181485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).