7-ethyl-4-methylundeca-2,5-diene

C14H26 — CID 91185821

IUPAC7-ethyl-4-methylundeca-2,5-diene
SMILESCC=CC(C)C=CC(CC)CCCC
InChIInChI=1S/C14H26/c1-5-8-10-14(7-3)12-11-13(4)9-6-2/h6,9,11-14H,5,7-8,10H2,1-4H3
InChIKeyFFTJGJHPAIJFSI-UHFFFAOYSA-N
MW194.36 g/mol
LogP4.97
Rot. Bonds7

About 7-ethyl-4-methylundeca-2,5-diene

7-ethyl-4-methylundeca-2,5-diene (PubChem CID 91185821) has the molecular formula C14H26 and a molecular weight of 194.36 g/mol. Its IUPAC name is 7-ethyl-4-methylundeca-2,5-diene.

Molecular Properties

Compound Name7-ethyl-4-methylundeca-2,5-diene
PubChem CID91185821
Molecular FormulaC14H26
Molecular Weight194.36 g/mol
Exact Mass194.20
IUPAC Name7-ethyl-4-methylundeca-2,5-diene
SMILESCC=CC(C)C=CC(CC)CCCC
InChIInChI=1S/C14H26/c1-5-8-10-14(7-3)12-11-13(4)9-6-2/h6,9,11-14H,5,7-8,10H2,1-4H3
InChIKeyFFTJGJHPAIJFSI-UHFFFAOYSA-N
XLogP4.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.36
LogP ≤ 54.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

4-ethylhept-2-ene
CID 54449444
5-prop-1-enyltridecane
CID 57064303
5-ethylnon-3-ene
CID 91177059
6-[(E)-prop-1-enyl]undecane
CID 134941128
4-methyloct-2-ene
CID 528286
2-prop-1-enylhexan-1-ol
CID 57263629
propane;(E)-5-[(Z)-prop-1-enyl]non-2-ene
CID 143978428
(Z)-but-2-ene;3-methylheptane
CID 155572467
3-ethylhept-1-ene
CID 12923943
3-ethylhex-4-en-1-amine
CID 123888745
2-ethylhexanal;phosphane
CID 174518467
2-ethylhexanal;methane
CID 139299505

Frequently Asked Questions

What is the IUPAC name of 7-ethyl-4-methylundeca-2,5-diene?
The IUPAC name of 7-ethyl-4-methylundeca-2,5-diene (CID 91185821) is 7-ethyl-4-methylundeca-2,5-diene.
What is the SMILES notation for 7-ethyl-4-methylundeca-2,5-diene?
The canonical SMILES for 7-ethyl-4-methylundeca-2,5-diene is CC=CC(C)C=CC(CC)CCCC.
What is the InChIKey of 7-ethyl-4-methylundeca-2,5-diene?
The InChIKey is FFTJGJHPAIJFSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26/c1-5-8-10-14(7-3)12-11-13(4)9-6-2/h6,9,11-14H,5,7-8,10H2,1-4H3.
What are the key properties of 7-ethyl-4-methylundeca-2,5-diene?
7-ethyl-4-methylundeca-2,5-diene has a molecular weight of 194.36 g/mol, XLogP of 4.97, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-4-methylundeca-2,5-diene is sourced from PubChem (CID 91185821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).