(3Z,6Z)-2,6-dimethyl-5-methylideneocta-1,3,6-triene

C11H16 — CID 166131805

IUPAC(3Z,6Z)-2,6-dimethyl-5-methylideneocta-1,3,6-triene
SMILESC=C(C)/C=C\C(=C)/C(C)=C\C
InChIInChI=1S/C11H16/c1-6-10(4)11(5)8-7-9(2)3/h6-8H,2,5H2,1,3-4H3/b8-7-,10-6-
InChIKeyWOXCSQOUXZQBFP-OYIUBJQVSA-N
MW148.25 g/mol
LogP3.64
Rot. Bonds3

About (3Z,6Z)-2,6-dimethyl-5-methylideneocta-1,3,6-triene

(3Z,6Z)-2,6-dimethyl-5-methylideneocta-1,3,6-triene (PubChem CID 166131805) has the molecular formula C11H16 and a molecular weight of 148.25 g/mol. Its IUPAC name is (3Z,6Z)-2,6-dimethyl-5-methylideneocta-1,3,6-triene.

Molecular Properties

Compound Name(3Z,6Z)-2,6-dimethyl-5-methylideneocta-1,3,6-triene
PubChem CID166131805
Molecular FormulaC11H16
Molecular Weight148.25 g/mol
Exact Mass148.13
IUPAC Name(3Z,6Z)-2,6-dimethyl-5-methylideneocta-1,3,6-triene
SMILESC=C(C)/C=C\C(=C)/C(C)=C\C
InChIInChI=1S/C11H16/c1-6-10(4)11(5)8-7-9(2)3/h6-8H,2,5H2,1,3-4H3/b8-7-,10-6-
InChIKeyWOXCSQOUXZQBFP-OYIUBJQVSA-N
XLogP3.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.25
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2,9-dimethyl-5,6-dimethylidenedeca-1,3,7,9-tetraene
CID 123828527
(3Z,7Z,9Z)-2,9-dimethyl-5,6-dimethylideneundeca-1,3,7,9-tetraene;ethane
CID 143933748
(3Z,5E)-5-bromo-2-methylhepta-1,3,5-triene;ethane
CID 144637545
ethane;(3Z,6E)-6-methyl-5-methylideneocta-1,3,6-triene
CID 145268478
(3Z,7Z)-2-fluoro-9-methyl-5,6-dimethylidenedeca-1,3,7,9-tetraene
CID 143485598
(3Z)-5-methyl-2-methylidenehexa-3,5-dienoic acid
CID 142042516
ethane;(4Z)-6-methyl-3-methylidenehepta-1,4,6-trien-2-amine
CID 143072241
(3Z,7Z)-2-fluoro-4,9-dimethyl-5,6-dimethylidenedeca-1,3,7,9-tetraene
CID 145480540
(3Z,7Z,11Z)-2-methyl-5,6,9,10-tetramethylidenetetradeca-1,3,7,11,13-pentaene
CID 143476273
(3Z,6E)-2,8-dimethyl-5-methylidenenona-1,3,6,8-tetraene;ethane;molecular hydrogen
CID 144794345
(3Z)-2-methyl-5-methylidenehepta-1,3,6-triene
CID 58174936
(3Z)-2,5-dimethylhexa-1,3,5-triene;ethane;propane
CID 144971150

Frequently Asked Questions

What is the IUPAC name of (3Z,6Z)-2,6-dimethyl-5-methylideneocta-1,3,6-triene?
The IUPAC name of (3Z,6Z)-2,6-dimethyl-5-methylideneocta-1,3,6-triene (CID 166131805) is (3Z,6Z)-2,6-dimethyl-5-methylideneocta-1,3,6-triene.
What is the SMILES notation for (3Z,6Z)-2,6-dimethyl-5-methylideneocta-1,3,6-triene?
The canonical SMILES for (3Z,6Z)-2,6-dimethyl-5-methylideneocta-1,3,6-triene is C=C(C)/C=C\C(=C)/C(C)=C\C.
What is the InChIKey of (3Z,6Z)-2,6-dimethyl-5-methylideneocta-1,3,6-triene?
The InChIKey is WOXCSQOUXZQBFP-OYIUBJQVSA-N. The full InChI is InChI=1S/C11H16/c1-6-10(4)11(5)8-7-9(2)3/h6-8H,2,5H2,1,3-4H3/b8-7-,10-6-.
What are the key properties of (3Z,6Z)-2,6-dimethyl-5-methylideneocta-1,3,6-triene?
(3Z,6Z)-2,6-dimethyl-5-methylideneocta-1,3,6-triene has a molecular weight of 148.25 g/mol, XLogP of 3.64, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,6Z)-2,6-dimethyl-5-methylideneocta-1,3,6-triene is sourced from PubChem (CID 166131805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).