2-methylnon-7-en-4-ol

C10H20O — CID 71320713

IUPAC2-methylnon-7-en-4-ol
SMILESCC=CCCC(O)CC(C)C
InChIInChI=1S/C10H20O/c1-4-5-6-7-10(11)8-9(2)3/h4-5,9-11H,6-8H2,1-3H3
InChIKeyHIZXCNKTCXFZQJ-UHFFFAOYSA-N
MW156.27 g/mol
LogP2.75
Rot. Bonds5

About 2-methylnon-7-en-4-ol

2-methylnon-7-en-4-ol (PubChem CID 71320713) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is 2-methylnon-7-en-4-ol.

Molecular Properties

Compound Name2-methylnon-7-en-4-ol
PubChem CID71320713
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Name2-methylnon-7-en-4-ol
SMILESCC=CCCC(O)CC(C)C
InChIInChI=1S/C10H20O/c1-4-5-6-7-10(11)8-9(2)3/h4-5,9-11H,6-8H2,1-3H3
InChIKeyHIZXCNKTCXFZQJ-UHFFFAOYSA-N
XLogP2.75
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 52.75
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 2-methylnon-7-en-4-ol?
The IUPAC name of 2-methylnon-7-en-4-ol (CID 71320713) is 2-methylnon-7-en-4-ol.
What is the SMILES notation for 2-methylnon-7-en-4-ol?
The canonical SMILES for 2-methylnon-7-en-4-ol is CC=CCCC(O)CC(C)C.
What is the InChIKey of 2-methylnon-7-en-4-ol?
The InChIKey is HIZXCNKTCXFZQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O/c1-4-5-6-7-10(11)8-9(2)3/h4-5,9-11H,6-8H2,1-3H3.
What are the key properties of 2-methylnon-7-en-4-ol?
2-methylnon-7-en-4-ol has a molecular weight of 156.27 g/mol, XLogP of 2.75, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylnon-7-en-4-ol is sourced from PubChem (CID 71320713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).