tetradec-1-en-4-ol

C14H28O — CID 11009268

IUPACtetradec-1-en-4-ol
SMILESC=CCC(O)CCCCCCCCCC
InChIInChI=1S/C14H28O/c1-3-5-6-7-8-9-10-11-13-14(15)12-4-2/h4,14-15H,2-3,5-13H2,1H3
InChIKeyNPDVSOMTSRVQCU-UHFFFAOYSA-N
MW212.38 g/mol
LogP4.45
Rot. Bonds11

About tetradec-1-en-4-ol

tetradec-1-en-4-ol (PubChem CID 11009268) has the molecular formula C14H28O and a molecular weight of 212.38 g/mol. Its IUPAC name is tetradec-1-en-4-ol.

Molecular Properties

Compound Nametetradec-1-en-4-ol
PubChem CID11009268
Molecular FormulaC14H28O
Molecular Weight212.38 g/mol
Exact Mass212.21
IUPAC Nametetradec-1-en-4-ol
SMILESC=CCC(O)CCCCCCCCCC
InChIInChI=1S/C14H28O/c1-3-5-6-7-8-9-10-11-13-14(15)12-4-2/h4,14-15H,2-3,5-13H2,1H3
InChIKeyNPDVSOMTSRVQCU-UHFFFAOYSA-N
XLogP4.45
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 54.45
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 tetradec-1-en-4-ol?
The IUPAC name of tetradec-1-en-4-ol (CID 11009268) is tetradec-1-en-4-ol.
What is the SMILES notation for tetradec-1-en-4-ol?
The canonical SMILES for tetradec-1-en-4-ol is C=CCC(O)CCCCCCCCCC.
What is the InChIKey of tetradec-1-en-4-ol?
The InChIKey is NPDVSOMTSRVQCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O/c1-3-5-6-7-8-9-10-11-13-14(15)12-4-2/h4,14-15H,2-3,5-13H2,1H3.
What are the key properties of tetradec-1-en-4-ol?
tetradec-1-en-4-ol has a molecular weight of 212.38 g/mol, XLogP of 4.45, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tetradec-1-en-4-ol is sourced from PubChem (CID 11009268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).