tetradec-5-yn-1-ol

C14H26O — CID 15730841

IUPACtetradec-5-yn-1-ol
SMILESCCCCCCCCC#CCCCCO
InChIInChI=1S/C14H26O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h15H,2-8,11-14H2,1H3
InChIKeyYAYVLVVDLNCCMO-UHFFFAOYSA-N
MW210.36 g/mol
LogP3.90
Rot. Bonds9

About tetradec-5-yn-1-ol

tetradec-5-yn-1-ol (PubChem CID 15730841) has the molecular formula C14H26O and a molecular weight of 210.36 g/mol. Its IUPAC name is tetradec-5-yn-1-ol.

Molecular Properties

Compound Nametetradec-5-yn-1-ol
PubChem CID15730841
Molecular FormulaC14H26O
Molecular Weight210.36 g/mol
Exact Mass210.20
IUPAC Nametetradec-5-yn-1-ol
SMILESCCCCCCCCC#CCCCCO
InChIInChI=1S/C14H26O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h15H,2-8,11-14H2,1H3
InChIKeyYAYVLVVDLNCCMO-UHFFFAOYSA-N
XLogP3.90
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

heptadec-8-yn-1-ol
CID 10491053
undec-5-yn-1-ol
CID 13113234
undec-7-yn-1-ol
CID 10909966
pentadeca-5,10-diyn-1-ol
CID 560933
pentacos-4-yne
CID 22223888
nonacos-4-yne
CID 22223961
henicos-8-yne
CID 22224321
hexadeca-9,11-diyn-1-ol
CID 24975633
octadec-2-yn-1-ol
CID 2825194
non-6-yn-1-ol
CID 3017913
hexadec-2-yn-1-ol
CID 11010038
henicosa-3,6,9-triyn-1-ol
CID 23255046

Frequently Asked Questions

What is the IUPAC name of tetradec-5-yn-1-ol?
The IUPAC name of tetradec-5-yn-1-ol (CID 15730841) is tetradec-5-yn-1-ol.
What is the SMILES notation for tetradec-5-yn-1-ol?
The canonical SMILES for tetradec-5-yn-1-ol is CCCCCCCCC#CCCCCO.
What is the InChIKey of tetradec-5-yn-1-ol?
The InChIKey is YAYVLVVDLNCCMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h15H,2-8,11-14H2,1H3.
What are the key properties of tetradec-5-yn-1-ol?
tetradec-5-yn-1-ol has a molecular weight of 210.36 g/mol, XLogP of 3.90, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tetradec-5-yn-1-ol is sourced from PubChem (CID 15730841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).