7-methyl-3-methylideneoct-6-en-1-ol

C10H18O — CID 518689

IUPAC7-methyl-3-methylideneoct-6-en-1-ol
SMILESC=C(CCO)CCC=C(C)C
InChIInChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,11H,3-4,6-8H2,1-2H3
InChIKeyLPYYZHAEKPCIHA-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.67
Rot. Bonds5

About 7-methyl-3-methylideneoct-6-en-1-ol

7-methyl-3-methylideneoct-6-en-1-ol (PubChem CID 518689) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 7-methyl-3-methylideneoct-6-en-1-ol.

Molecular Properties

Compound Name7-methyl-3-methylideneoct-6-en-1-ol
PubChem CID518689
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name7-methyl-3-methylideneoct-6-en-1-ol
SMILESC=C(CCO)CCC=C(C)C
InChIInChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,11H,3-4,6-8H2,1-2H3
InChIKeyLPYYZHAEKPCIHA-UHFFFAOYSA-N
XLogP2.67
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.67
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 7-methyl-3-methylideneoct-6-en-1-ol?
The IUPAC name of 7-methyl-3-methylideneoct-6-en-1-ol (CID 518689) is 7-methyl-3-methylideneoct-6-en-1-ol.
What is the SMILES notation for 7-methyl-3-methylideneoct-6-en-1-ol?
The canonical SMILES for 7-methyl-3-methylideneoct-6-en-1-ol is C=C(CCO)CCC=C(C)C.
What is the InChIKey of 7-methyl-3-methylideneoct-6-en-1-ol?
The InChIKey is LPYYZHAEKPCIHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,11H,3-4,6-8H2,1-2H3.
What are the key properties of 7-methyl-3-methylideneoct-6-en-1-ol?
7-methyl-3-methylideneoct-6-en-1-ol has a molecular weight of 154.25 g/mol, XLogP of 2.67, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-3-methylideneoct-6-en-1-ol is sourced from PubChem (CID 518689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).