(2Z,4Z,6Z)-4-methyl-5-propylocta-2,4,6-triene

C12H20 — CID 144517044

IUPAC(2Z,4Z,6Z)-4-methyl-5-propylocta-2,4,6-triene
SMILESC/C=C\C(C)=C(/C=C\C)CCC
InChIInChI=1S/C12H20/c1-5-8-11(4)12(9-6-2)10-7-3/h5-6,8-9H,7,10H2,1-4H3/b8-5-,9-6-,12-11+
InChIKeyPTNMZDMYLRZVGB-HNNSWSEXSA-N
MW164.29 g/mol
LogP4.26
Rot. Bonds4

About (2Z,4Z,6Z)-4-methyl-5-propylocta-2,4,6-triene

(2Z,4Z,6Z)-4-methyl-5-propylocta-2,4,6-triene (PubChem CID 144517044) has the molecular formula C12H20 and a molecular weight of 164.29 g/mol. Its IUPAC name is (2Z,4Z,6Z)-4-methyl-5-propylocta-2,4,6-triene.

Molecular Properties

Compound Name(2Z,4Z,6Z)-4-methyl-5-propylocta-2,4,6-triene
PubChem CID144517044
Molecular FormulaC12H20
Molecular Weight164.29 g/mol
Exact Mass164.16
IUPAC Name(2Z,4Z,6Z)-4-methyl-5-propylocta-2,4,6-triene
SMILESC/C=C\C(C)=C(/C=C\C)CCC
InChIInChI=1S/C12H20/c1-5-8-11(4)12(9-6-2)10-7-3/h5-6,8-9H,7,10H2,1-4H3/b8-5-,9-6-,12-11+
InChIKeyPTNMZDMYLRZVGB-HNNSWSEXSA-N
XLogP4.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.29
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (2Z,4Z,6Z)-4-methyl-5-propylocta-2,4,6-triene with MolForge

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Launch Full Analysis

Related Compounds

ethane;(3E,5Z)-4-propylhepta-1,3,5-trien-3-ol
CID 143682761
ethane;(3Z,5Z)-3-ethyl-4-methylhepta-1,3,5-triene
CID 142883433
(2Z,4Z,6E)-4,5-dimethylocta-2,4,6-triene;ethane
CID 143078832
but-2-enoic acid;pentan-2-one
CID 175320789
(2Z,4E,6Z,9Z)-4,5-dimethylundeca-2,4,6,9-tetraene
CID 142044240
N-[(2Z,4Z)-hexa-2,4-dien-3-yl]pentan-2-imine
CID 142099496
(Z)-5-propan-2-ylideneoct-3-ene
CID 171660172
(2Z,4E,6Z)-4-ethoxy-5-methylocta-2,4,6-triene
CID 143146513
(Z,5Z)-5-ethylidene-4-methylideneoct-2-ene
CID 166467413
ethane;ethene;(3E,5E,7E)-6-methyl-5-prop-1-en-2-yl-4-propylnona-1,3,5,7-tetraene;prop-1-ene
CID 143912708
(2R,4Z,6Z)-4-ethenyl-5-methylocta-4,6-dien-2-ol
CID 143045895
4,5,6,7-tetramethylundeca-2,4,6,9-tetraene
CID 123835298

Frequently Asked Questions

What is the IUPAC name of (2Z,4Z,6Z)-4-methyl-5-propylocta-2,4,6-triene?
The IUPAC name of (2Z,4Z,6Z)-4-methyl-5-propylocta-2,4,6-triene (CID 144517044) is (2Z,4Z,6Z)-4-methyl-5-propylocta-2,4,6-triene.
What is the SMILES notation for (2Z,4Z,6Z)-4-methyl-5-propylocta-2,4,6-triene?
The canonical SMILES for (2Z,4Z,6Z)-4-methyl-5-propylocta-2,4,6-triene is C/C=C\C(C)=C(/C=C\C)CCC.
What is the InChIKey of (2Z,4Z,6Z)-4-methyl-5-propylocta-2,4,6-triene?
The InChIKey is PTNMZDMYLRZVGB-HNNSWSEXSA-N. The full InChI is InChI=1S/C12H20/c1-5-8-11(4)12(9-6-2)10-7-3/h5-6,8-9H,7,10H2,1-4H3/b8-5-,9-6-,12-11+.
What are the key properties of (2Z,4Z,6Z)-4-methyl-5-propylocta-2,4,6-triene?
(2Z,4Z,6Z)-4-methyl-5-propylocta-2,4,6-triene has a molecular weight of 164.29 g/mol, XLogP of 4.26, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,4Z,6Z)-4-methyl-5-propylocta-2,4,6-triene is sourced from PubChem (CID 144517044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).