pentadeca-4,10-diene

C15H28 — CID 54306056

IUPACpentadeca-4,10-diene
SMILESCCCC=CCCCCC=CCCCC
InChIInChI=1S/C15H28/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2/h7,9-10,12H,3-6,8,11,13-15H2,1-2H3
InChIKeySHORALNJFMTEDT-UHFFFAOYSA-N
MW208.39 g/mol
LogP5.65
Rot. Bonds10

About pentadeca-4,10-diene

pentadeca-4,10-diene (PubChem CID 54306056) has the molecular formula C15H28 and a molecular weight of 208.39 g/mol. Its IUPAC name is pentadeca-4,10-diene.

Molecular Properties

Compound Namepentadeca-4,10-diene
PubChem CID54306056
Molecular FormulaC15H28
Molecular Weight208.39 g/mol
Exact Mass208.22
IUPAC Namepentadeca-4,10-diene
SMILESCCCC=CCCCCC=CCCCC
InChIInChI=1S/C15H28/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2/h7,9-10,12H,3-6,8,11,13-15H2,1-2H3
InChIKeySHORALNJFMTEDT-UHFFFAOYSA-N
XLogP5.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500208.39
LogP ≤ 55.65
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

(4E,9Z)-tetradeca-4,9-diene
CID 152732976
(Z)-tridec-4-ene
CID 5362712
(Z)-tridec-6-ene;(Z)-undec-4-ene
CID 161365587
henicosa-4,14-diene
CID 91309991
tricosa-4,19-diene
CID 142680711
hexadeca-4,12-diene
CID 71384995
dodec-4-ene;hydrochloride
CID 175415968
pentadeca-4,8-diene
CID 90864504
docos-5-ene
CID 54227700
nonadec-5-ene
CID 543596
dec-5-ene;trihydrobromide
CID 175802238
dodec-4-ene;ethene
CID 175558519

Frequently Asked Questions

What is the IUPAC name of pentadeca-4,10-diene?
The IUPAC name of pentadeca-4,10-diene (CID 54306056) is pentadeca-4,10-diene.
What is the SMILES notation for pentadeca-4,10-diene?
The canonical SMILES for pentadeca-4,10-diene is CCCC=CCCCCC=CCCCC.
What is the InChIKey of pentadeca-4,10-diene?
The InChIKey is SHORALNJFMTEDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2/h7,9-10,12H,3-6,8,11,13-15H2,1-2H3.
What are the key properties of pentadeca-4,10-diene?
pentadeca-4,10-diene has a molecular weight of 208.39 g/mol, XLogP of 5.65, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for pentadeca-4,10-diene is sourced from PubChem (CID 54306056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).