6,8-dimethylidenetridec-2-ene

C15H26 — CID 123762640

IUPAC6,8-dimethylidenetridec-2-ene
SMILESC=C(CCC=CC)CC(=C)CCCCC
InChIInChI=1S/C15H26/c1-5-7-9-11-14(3)13-15(4)12-10-8-6-2/h5,7H,3-4,6,8-13H2,1-2H3
InChIKeyONRPKCINNWPHKT-UHFFFAOYSA-N
MW206.37 g/mol
LogP5.43
Rot. Bonds9

About 6,8-dimethylidenetridec-2-ene

6,8-dimethylidenetridec-2-ene (PubChem CID 123762640) has the molecular formula C15H26 and a molecular weight of 206.37 g/mol. Its IUPAC name is 6,8-dimethylidenetridec-2-ene.

Molecular Properties

Compound Name6,8-dimethylidenetridec-2-ene
PubChem CID123762640
Molecular FormulaC15H26
Molecular Weight206.37 g/mol
Exact Mass206.20
IUPAC Name6,8-dimethylidenetridec-2-ene
SMILESC=C(CCC=CC)CC(=C)CCCCC
InChIInChI=1S/C15H26/c1-5-7-9-11-14(3)13-15(4)12-10-8-6-2/h5,7H,3-4,6,8-13H2,1-2H3
InChIKeyONRPKCINNWPHKT-UHFFFAOYSA-N
XLogP5.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500206.37
LogP ≤ 55.43
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

3-methyl-5-methylidenedec-2-ene
CID 172548284
6-methylidenetetradecane
CID 21477883
6-methylidenedodecane
CID 21453027
(Z)-oct-2-ene
CID 5356796
hexane;(Z)-hex-2-ene
CID 159343029
undec-2-en-6-one;hydrochloride
CID 175086863
3-methyl-5-methylidenenon-2-ene
CID 86209707
19-methylideneheptatriacontane;titanium
CID 174477367
(Z)-icos-2-ene
CID 5352524
hept-2-ene;methanol
CID 135236025
oct-2-ene;hydrochloride
CID 86744102
3-methylidenetetradecanoic acid
CID 89137857

Frequently Asked Questions

What is the IUPAC name of 6,8-dimethylidenetridec-2-ene?
The IUPAC name of 6,8-dimethylidenetridec-2-ene (CID 123762640) is 6,8-dimethylidenetridec-2-ene.
What is the SMILES notation for 6,8-dimethylidenetridec-2-ene?
The canonical SMILES for 6,8-dimethylidenetridec-2-ene is C=C(CCC=CC)CC(=C)CCCCC.
What is the InChIKey of 6,8-dimethylidenetridec-2-ene?
The InChIKey is ONRPKCINNWPHKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26/c1-5-7-9-11-14(3)13-15(4)12-10-8-6-2/h5,7H,3-4,6,8-13H2,1-2H3.
What are the key properties of 6,8-dimethylidenetridec-2-ene?
6,8-dimethylidenetridec-2-ene has a molecular weight of 206.37 g/mol, XLogP of 5.43, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-dimethylidenetridec-2-ene is sourced from PubChem (CID 123762640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).