(2Z,6E)-dodeca-2,6-diene;palladium

C12H22Pd — CID 158734810

IUPAC(2Z,6E)-dodeca-2,6-diene;palladium
SMILESC/C=C\CC/C=C/CCCCC.[Pd]
InChIInChI=1S/C12H22.Pd/c1-3-5-7-9-11-12-10-8-6-4-2;/h3,5,11-12H,4,6-10H2,1-2H3;/b5-3-,12-11+;
InChIKeyILNYAOCLWCXBFU-YHIXZESSSA-N
MW272.73 g/mol
LogP4.48
Rot. Bonds7

About (2Z,6E)-dodeca-2,6-diene;palladium

(2Z,6E)-dodeca-2,6-diene;palladium (PubChem CID 158734810) has the molecular formula C12H22Pd and a molecular weight of 272.73 g/mol. Its IUPAC name is (2Z,6E)-dodeca-2,6-diene;palladium.

Molecular Properties

Compound Name(2Z,6E)-dodeca-2,6-diene;palladium
PubChem CID158734810
Molecular FormulaC12H22Pd
Molecular Weight272.73 g/mol
Exact Mass272.08
IUPAC Name(2Z,6E)-dodeca-2,6-diene;palladium
SMILESC/C=C\CC/C=C/CCCCC.[Pd]
InChIInChI=1S/C12H22.Pd/c1-3-5-7-9-11-12-10-8-6-4-2;/h3,5,11-12H,4,6-10H2,1-2H3;/b5-3-,12-11+;
InChIKeyILNYAOCLWCXBFU-YHIXZESSSA-N
XLogP4.48
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.73
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

pentadeca-2,6-diene
CID 165019979
octadeca-2,10-diene
CID 54270716
(2E,8Z)-pentadeca-2,8-diene
CID 173032001
(Z)-oct-2-ene
CID 5356796
(Z)-icos-2-ene
CID 5352524
oct-2-ene;hydrochloride
CID 86744102
pentadeca-2,10-diene
CID 174048350
(6E,10Z,14E)-icosa-6,10,14-triene
CID 53230462
sodium;hydride;octadec-2-ene
CID 175594563
(2E,7E)-dodeca-2,7-diene
CID 173295735
(5E,9E)-nonacosa-5,9-diene
CID 56936191
hexane;(Z)-hex-2-ene
CID 159343029

Frequently Asked Questions

What is the IUPAC name of (2Z,6E)-dodeca-2,6-diene;palladium?
The IUPAC name of (2Z,6E)-dodeca-2,6-diene;palladium (CID 158734810) is (2Z,6E)-dodeca-2,6-diene;palladium.
What is the SMILES notation for (2Z,6E)-dodeca-2,6-diene;palladium?
The canonical SMILES for (2Z,6E)-dodeca-2,6-diene;palladium is C/C=C\CC/C=C/CCCCC.[Pd].
What is the InChIKey of (2Z,6E)-dodeca-2,6-diene;palladium?
The InChIKey is ILNYAOCLWCXBFU-YHIXZESSSA-N. The full InChI is InChI=1S/C12H22.Pd/c1-3-5-7-9-11-12-10-8-6-4-2;/h3,5,11-12H,4,6-10H2,1-2H3;/b5-3-,12-11+;.
What are the key properties of (2Z,6E)-dodeca-2,6-diene;palladium?
(2Z,6E)-dodeca-2,6-diene;palladium has a molecular weight of 272.73 g/mol, XLogP of 4.48, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,6E)-dodeca-2,6-diene;palladium is sourced from PubChem (CID 158734810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).