6-ethyl-7-methyl-3-methylidenedeca-1,6-diene

C14H24 — CID 54189290

IUPAC6-ethyl-7-methyl-3-methylidenedeca-1,6-diene
SMILESC=CC(=C)CCC(CC)=C(C)CCC
InChIInChI=1S/C14H24/c1-6-9-13(5)14(8-3)11-10-12(4)7-2/h7H,2,4,6,8-11H2,1,3,5H3
InChIKeyPHITZJSWVMUUCG-UHFFFAOYSA-N
MW192.35 g/mol
LogP5.04
Rot. Bonds7

About 6-ethyl-7-methyl-3-methylidenedeca-1,6-diene

6-ethyl-7-methyl-3-methylidenedeca-1,6-diene (PubChem CID 54189290) has the molecular formula C14H24 and a molecular weight of 192.35 g/mol. Its IUPAC name is 6-ethyl-7-methyl-3-methylidenedeca-1,6-diene.

Molecular Properties

Compound Name6-ethyl-7-methyl-3-methylidenedeca-1,6-diene
PubChem CID54189290
Molecular FormulaC14H24
Molecular Weight192.35 g/mol
Exact Mass192.19
IUPAC Name6-ethyl-7-methyl-3-methylidenedeca-1,6-diene
SMILESC=CC(=C)CCC(CC)=C(C)CCC
InChIInChI=1S/C14H24/c1-6-9-13(5)14(8-3)11-10-12(4)7-2/h7H,2,4,6,8-11H2,1,3,5H3
InChIKeyPHITZJSWVMUUCG-UHFFFAOYSA-N
XLogP5.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500192.35
LogP ≤ 55.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-7-methyl-3-methylidenedeca-1,6-diene?
The IUPAC name of 6-ethyl-7-methyl-3-methylidenedeca-1,6-diene (CID 54189290) is 6-ethyl-7-methyl-3-methylidenedeca-1,6-diene.
What is the SMILES notation for 6-ethyl-7-methyl-3-methylidenedeca-1,6-diene?
The canonical SMILES for 6-ethyl-7-methyl-3-methylidenedeca-1,6-diene is C=CC(=C)CCC(CC)=C(C)CCC.
What is the InChIKey of 6-ethyl-7-methyl-3-methylidenedeca-1,6-diene?
The InChIKey is PHITZJSWVMUUCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24/c1-6-9-13(5)14(8-3)11-10-12(4)7-2/h7H,2,4,6,8-11H2,1,3,5H3.
What are the key properties of 6-ethyl-7-methyl-3-methylidenedeca-1,6-diene?
6-ethyl-7-methyl-3-methylidenedeca-1,6-diene has a molecular weight of 192.35 g/mol, XLogP of 5.04, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-7-methyl-3-methylidenedeca-1,6-diene is sourced from PubChem (CID 54189290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).