11-methyltrideca-5,7-diene

C14H26 — CID 91357008

IUPAC11-methyltrideca-5,7-diene
SMILESCCCCC=CC=CCCC(C)CC
InChIInChI=1S/C14H26/c1-4-6-7-8-9-10-11-12-13-14(3)5-2/h8-11,14H,4-7,12-13H2,1-3H3
InChIKeyGFKBIHPHEXKMOL-UHFFFAOYSA-N
MW194.36 g/mol
LogP5.12
Rot. Bonds8

About 11-methyltrideca-5,7-diene

11-methyltrideca-5,7-diene (PubChem CID 91357008) has the molecular formula C14H26 and a molecular weight of 194.36 g/mol. Its IUPAC name is 11-methyltrideca-5,7-diene.

Molecular Properties

Compound Name11-methyltrideca-5,7-diene
PubChem CID91357008
Molecular FormulaC14H26
Molecular Weight194.36 g/mol
Exact Mass194.20
IUPAC Name11-methyltrideca-5,7-diene
SMILESCCCCC=CC=CCCC(C)CC
InChIInChI=1S/C14H26/c1-4-6-7-8-9-10-11-12-13-14(3)5-2/h8-11,14H,4-7,12-13H2,1-3H3
InChIKeyGFKBIHPHEXKMOL-UHFFFAOYSA-N
XLogP5.12
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500194.36
LogP ≤ 55.12
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

(Z)-3-methylheptadec-6-ene
CID 159647190
2,9-dimethylundec-5-ene
CID 123952487
2,11-dimethyltridec-6-ene
CID 123657363
8-methyldeca-2,4-dienoic acid
CID 154133307
(E,5R)-2,5-dimethylheptadec-8-ene
CID 11097499
(5E,7E)-hexadeca-5,7-diene
CID 13032294
(5Z,7Z)-pentadeca-5,7-diene
CID 14270938
(Z)-11-methyldodec-5-ene
CID 159147265
5-methylheptadec-8-ene
CID 162470798
(E)-5,17,23-trimethylheptacos-13-ene
CID 173194440
tetrakis(oct-3-enyl)phosphanium
CID 154360446
magnesium;(4Z,6E)-undeca-4,6-diene;iodide
CID 170549986

Frequently Asked Questions

What is the IUPAC name of 11-methyltrideca-5,7-diene?
The IUPAC name of 11-methyltrideca-5,7-diene (CID 91357008) is 11-methyltrideca-5,7-diene.
What is the SMILES notation for 11-methyltrideca-5,7-diene?
The canonical SMILES for 11-methyltrideca-5,7-diene is CCCCC=CC=CCCC(C)CC.
What is the InChIKey of 11-methyltrideca-5,7-diene?
The InChIKey is GFKBIHPHEXKMOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26/c1-4-6-7-8-9-10-11-12-13-14(3)5-2/h8-11,14H,4-7,12-13H2,1-3H3.
What are the key properties of 11-methyltrideca-5,7-diene?
11-methyltrideca-5,7-diene has a molecular weight of 194.36 g/mol, XLogP of 5.12, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 11-methyltrideca-5,7-diene is sourced from PubChem (CID 91357008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).