trideca-1,10-diene

C13H24 — CID 54351837

IUPACtrideca-1,10-diene
SMILESC=CCCCCCCCC=CCC
InChIInChI=1S/C13H24/c1-3-5-7-9-11-13-12-10-8-6-4-2/h3,6,8H,1,4-5,7,9-13H2,2H3
InChIKeyUGHSGGRCAOKTTQ-UHFFFAOYSA-N
MW180.33 g/mol
LogP4.87
Rot. Bonds9

About trideca-1,10-diene

trideca-1,10-diene (PubChem CID 54351837) has the molecular formula C13H24 and a molecular weight of 180.33 g/mol. Its IUPAC name is trideca-1,10-diene.

Molecular Properties

Compound Nametrideca-1,10-diene
PubChem CID54351837
Molecular FormulaC13H24
Molecular Weight180.33 g/mol
Exact Mass180.19
IUPAC Nametrideca-1,10-diene
SMILESC=CCCCCCCCC=CCC
InChIInChI=1S/C13H24/c1-3-5-7-9-11-13-12-10-8-6-4-2/h3,6,8H,1,4-5,7,9-13H2,2H3
InChIKeyUGHSGGRCAOKTTQ-UHFFFAOYSA-N
XLogP4.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.33
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

hexadeca-1,5,13-triene
CID 174048718
(3E,16E)-nonadeca-3,16-diene
CID 157471321
heptahexaconta-1,23,66-triene
CID 57275880
icosa-1,9,19-triene
CID 57001912
(12Z,14Z)-heptadeca-1,12,14-triene
CID 6443230
trideca-1,8,10-triene
CID 548898
pentaconta-1,25-diene
CID 90941740
(11E)-pentadeca-1,11-diene
CID 15206768
pentacosa-1,9,15-triene
CID 90876289
tetradeca-1,8-diene
CID 90913546
heptadeca-1,7-diene
CID 57204265
triaconta-1,19-diene
CID 54007897

Frequently Asked Questions

What is the IUPAC name of trideca-1,10-diene?
The IUPAC name of trideca-1,10-diene (CID 54351837) is trideca-1,10-diene.
What is the SMILES notation for trideca-1,10-diene?
The canonical SMILES for trideca-1,10-diene is C=CCCCCCCCC=CCC.
What is the InChIKey of trideca-1,10-diene?
The InChIKey is UGHSGGRCAOKTTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24/c1-3-5-7-9-11-13-12-10-8-6-4-2/h3,6,8H,1,4-5,7,9-13H2,2H3.
What are the key properties of trideca-1,10-diene?
trideca-1,10-diene has a molecular weight of 180.33 g/mol, XLogP of 4.87, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trideca-1,10-diene is sourced from PubChem (CID 54351837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).