4-ethenyl-2,4,8-trimethylnon-7-en-3-ol

C14H26O — CID 88757080

IUPAC4-ethenyl-2,4,8-trimethylnon-7-en-3-ol
SMILESC=CC(C)(CCC=C(C)C)C(O)C(C)C
InChIInChI=1S/C14H26O/c1-7-14(6,13(15)12(4)5)10-8-9-11(2)3/h7,9,12-13,15H,1,8,10H2,2-6H3
InChIKeyWWZHGAHPDAHLQY-UHFFFAOYSA-N
MW210.36 g/mol
LogP3.94
Rot. Bonds6

About 4-ethenyl-2,4,8-trimethylnon-7-en-3-ol

4-ethenyl-2,4,8-trimethylnon-7-en-3-ol (PubChem CID 88757080) has the molecular formula C14H26O and a molecular weight of 210.36 g/mol. Its IUPAC name is 4-ethenyl-2,4,8-trimethylnon-7-en-3-ol.

Molecular Properties

Compound Name4-ethenyl-2,4,8-trimethylnon-7-en-3-ol
PubChem CID88757080
Molecular FormulaC14H26O
Molecular Weight210.36 g/mol
Exact Mass210.20
IUPAC Name4-ethenyl-2,4,8-trimethylnon-7-en-3-ol
SMILESC=CC(C)(CCC=C(C)C)C(O)C(C)C
InChIInChI=1S/C14H26O/c1-7-14(6,13(15)12(4)5)10-8-9-11(2)3/h7,9,12-13,15H,1,8,10H2,2-6H3
InChIKeyWWZHGAHPDAHLQY-UHFFFAOYSA-N
XLogP3.94
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 53.94
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 4-ethenyl-2,4,8-trimethylnon-7-en-3-ol?
The IUPAC name of 4-ethenyl-2,4,8-trimethylnon-7-en-3-ol (CID 88757080) is 4-ethenyl-2,4,8-trimethylnon-7-en-3-ol.
What is the SMILES notation for 4-ethenyl-2,4,8-trimethylnon-7-en-3-ol?
The canonical SMILES for 4-ethenyl-2,4,8-trimethylnon-7-en-3-ol is C=CC(C)(CCC=C(C)C)C(O)C(C)C.
What is the InChIKey of 4-ethenyl-2,4,8-trimethylnon-7-en-3-ol?
The InChIKey is WWZHGAHPDAHLQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O/c1-7-14(6,13(15)12(4)5)10-8-9-11(2)3/h7,9,12-13,15H,1,8,10H2,2-6H3.
What are the key properties of 4-ethenyl-2,4,8-trimethylnon-7-en-3-ol?
4-ethenyl-2,4,8-trimethylnon-7-en-3-ol has a molecular weight of 210.36 g/mol, XLogP of 3.94, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-2,4,8-trimethylnon-7-en-3-ol is sourced from PubChem (CID 88757080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).