pentadeca-3,5,7,9-tetraene

C15H24 — CID 151958393

IUPACpentadeca-3,5,7,9-tetraene
SMILESCCC=CC=CC=CC=CCCCCC
InChIInChI=1S/C15H24/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2/h5,7,9,11-15H,3-4,6,8,10H2,1-2H3
InChIKeyTYCWRVKYYCVPMN-UHFFFAOYSA-N
MW204.36 g/mol
LogP5.20
Rot. Bonds8

About pentadeca-3,5,7,9-tetraene

pentadeca-3,5,7,9-tetraene (PubChem CID 151958393) has the molecular formula C15H24 and a molecular weight of 204.36 g/mol. Its IUPAC name is pentadeca-3,5,7,9-tetraene.

Molecular Properties

Compound Namepentadeca-3,5,7,9-tetraene
PubChem CID151958393
Molecular FormulaC15H24
Molecular Weight204.36 g/mol
Exact Mass204.19
IUPAC Namepentadeca-3,5,7,9-tetraene
SMILESCCC=CC=CC=CC=CCCCCC
InChIInChI=1S/C15H24/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2/h5,7,9,11-15H,3-4,6,8,10H2,1-2H3
InChIKeyTYCWRVKYYCVPMN-UHFFFAOYSA-N
XLogP5.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500204.36
LogP ≤ 55.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(3E,5Z,9Z)-pentadeca-3,5,9-triene
CID 90384035
(22E)-heptatetraconta-22,24-diene
CID 56629131
pentacosa-3,9,11,15-tetraene
CID 141068852
(5E,7E)-hexadeca-5,7-diene
CID 13032294
(5Z,7Z)-pentadeca-5,7-diene
CID 14270938
(2E,4E,6E)-dodeca-2,4,6-triene
CID 10975832
(6E)-octadeca-4,6-diene
CID 173243345
pentadeca-3,5,7,12-tetraene
CID 142697862
(E)-non-3-ene
CID 5364445
(2Z)-deca-2,4-dienal
CID 87792972
pentadeca-6,8,10,12-tetraenal
CID 78382191
1-bromododeca-2,4,6-triene
CID 87237823

Frequently Asked Questions

What is the IUPAC name of pentadeca-3,5,7,9-tetraene?
The IUPAC name of pentadeca-3,5,7,9-tetraene (CID 151958393) is pentadeca-3,5,7,9-tetraene.
What is the SMILES notation for pentadeca-3,5,7,9-tetraene?
The canonical SMILES for pentadeca-3,5,7,9-tetraene is CCC=CC=CC=CC=CCCCCC.
What is the InChIKey of pentadeca-3,5,7,9-tetraene?
The InChIKey is TYCWRVKYYCVPMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2/h5,7,9,11-15H,3-4,6,8,10H2,1-2H3.
What are the key properties of pentadeca-3,5,7,9-tetraene?
pentadeca-3,5,7,9-tetraene has a molecular weight of 204.36 g/mol, XLogP of 5.20, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for pentadeca-3,5,7,9-tetraene is sourced from PubChem (CID 151958393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).