1,1,1-trifluoroundec-10-en-2-ol

C11H19F3O — CID 71485095

IUPAC1,1,1-trifluoroundec-10-en-2-ol
SMILESC=CCCCCCCCC(O)C(F)(F)F
InChIInChI=1S/C11H19F3O/c1-2-3-4-5-6-7-8-9-10(15)11(12,13)14/h2,10,15H,1,3-9H2
InChIKeyZHACWGORCWJCNP-UHFFFAOYSA-N
MW224.27 g/mol
LogP3.83
Rot. Bonds8

About 1,1,1-trifluoroundec-10-en-2-ol

1,1,1-trifluoroundec-10-en-2-ol (PubChem CID 71485095) has the molecular formula C11H19F3O and a molecular weight of 224.27 g/mol. Its IUPAC name is 1,1,1-trifluoroundec-10-en-2-ol.

Molecular Properties

Compound Name1,1,1-trifluoroundec-10-en-2-ol
PubChem CID71485095
Molecular FormulaC11H19F3O
Molecular Weight224.27 g/mol
Exact Mass224.14
IUPAC Name1,1,1-trifluoroundec-10-en-2-ol
SMILESC=CCCCCCCCC(O)C(F)(F)F
InChIInChI=1S/C11H19F3O/c1-2-3-4-5-6-7-8-9-10(15)11(12,13)14/h2,10,15H,1,3-9H2
InChIKeyZHACWGORCWJCNP-UHFFFAOYSA-N
XLogP3.83
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.27
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1,1,1-trifluoroundec-10-en-2-ol?
The IUPAC name of 1,1,1-trifluoroundec-10-en-2-ol (CID 71485095) is 1,1,1-trifluoroundec-10-en-2-ol.
What is the SMILES notation for 1,1,1-trifluoroundec-10-en-2-ol?
The canonical SMILES for 1,1,1-trifluoroundec-10-en-2-ol is C=CCCCCCCCC(O)C(F)(F)F.
What is the InChIKey of 1,1,1-trifluoroundec-10-en-2-ol?
The InChIKey is ZHACWGORCWJCNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F3O/c1-2-3-4-5-6-7-8-9-10(15)11(12,13)14/h2,10,15H,1,3-9H2.
What are the key properties of 1,1,1-trifluoroundec-10-en-2-ol?
1,1,1-trifluoroundec-10-en-2-ol has a molecular weight of 224.27 g/mol, XLogP of 3.83, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1-trifluoroundec-10-en-2-ol is sourced from PubChem (CID 71485095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).