(E)-5-methylidenetridec-6-ene

C14H26 — CID 10976379

IUPAC(E)-5-methylidenetridec-6-ene
SMILESC=C(/C=C/CCCCCC)CCCC
InChIInChI=1S/C14H26/c1-4-6-8-9-10-11-13-14(3)12-7-5-2/h11,13H,3-10,12H2,1-2H3/b13-11+
InChIKeyVYLQKKFTQQLYTJ-ACCUITESSA-N
MW194.36 g/mol
LogP5.26
Rot. Bonds9

About (E)-5-methylidenetridec-6-ene

(E)-5-methylidenetridec-6-ene (PubChem CID 10976379) has the molecular formula C14H26 and a molecular weight of 194.36 g/mol. Its IUPAC name is (E)-5-methylidenetridec-6-ene.

Molecular Properties

Compound Name(E)-5-methylidenetridec-6-ene
PubChem CID10976379
Molecular FormulaC14H26
Molecular Weight194.36 g/mol
Exact Mass194.20
IUPAC Name(E)-5-methylidenetridec-6-ene
SMILESC=C(/C=C/CCCCCC)CCCC
InChIInChI=1S/C14H26/c1-4-6-8-9-10-11-13-14(3)12-7-5-2/h11,13H,3-10,12H2,1-2H3/b13-11+
InChIKeyVYLQKKFTQQLYTJ-ACCUITESSA-N
XLogP5.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500194.36
LogP ≤ 55.26
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

Terpinolene
CID 11463
Myrcene
CID 31253
trans-Alloocimene
CID 5368821
Farnesene
CID 5281516
beta-Ocimene
CID 18756
beta-Farnesene
CID 5281517
beta-Ocimene, (3Z)-
CID 5320250
beta-OCIMENE, (3E)-
CID 5281553
Vinylcyclohexene
CID 17497
2,6-Dimethylocta-2,4,6-triene
CID 12658
1,3,5-Undecatriene
CID 61832
(3E,5E)-1,3,5-Undecatriene
CID 5367412

Frequently Asked Questions

What is the IUPAC name of (E)-5-methylidenetridec-6-ene?
The IUPAC name of (E)-5-methylidenetridec-6-ene (CID 10976379) is (E)-5-methylidenetridec-6-ene.
What is the SMILES notation for (E)-5-methylidenetridec-6-ene?
The canonical SMILES for (E)-5-methylidenetridec-6-ene is C=C(/C=C/CCCCCC)CCCC.
What is the InChIKey of (E)-5-methylidenetridec-6-ene?
The InChIKey is VYLQKKFTQQLYTJ-ACCUITESSA-N. The full InChI is InChI=1S/C14H26/c1-4-6-8-9-10-11-13-14(3)12-7-5-2/h11,13H,3-10,12H2,1-2H3/b13-11+.
What are the key properties of (E)-5-methylidenetridec-6-ene?
(E)-5-methylidenetridec-6-ene has a molecular weight of 194.36 g/mol, XLogP of 5.26, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-5-methylidenetridec-6-ene is sourced from PubChem (CID 10976379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).