dichlorozinc;(6E)-2,6-dimethylocta-2,6-diene

C10H18Cl2Zn — CID 174338717

IUPACdichlorozinc;(6E)-2,6-dimethylocta-2,6-diene
SMILESC/C=C(\C)CCC=C(C)C.Cl[Zn]Cl
InChIInChI=1S/C10H18.2ClH.Zn/c1-5-10(4)8-6-7-9(2)3;;;/h5,7H,6,8H2,1-4H3;2*1H;/q;;;+2/p-2/b10-5+;;;
InChIKeyIUYBJIOJYDDGOF-RWWJYAHQSA-L
MW274.55 g/mol
LogP5.08
Rot. Bonds3

About dichlorozinc;(6E)-2,6-dimethylocta-2,6-diene

dichlorozinc;(6E)-2,6-dimethylocta-2,6-diene (PubChem CID 174338717) has the molecular formula C10H18Cl2Zn and a molecular weight of 274.55 g/mol. Its IUPAC name is dichlorozinc;(6E)-2,6-dimethylocta-2,6-diene.

Molecular Properties

Compound Namedichlorozinc;(6E)-2,6-dimethylocta-2,6-diene
PubChem CID174338717
Molecular FormulaC10H18Cl2Zn
Molecular Weight274.55 g/mol
Exact Mass272.01
IUPAC Namedichlorozinc;(6E)-2,6-dimethylocta-2,6-diene
SMILESC/C=C(\C)CCC=C(C)C.Cl[Zn]Cl
InChIInChI=1S/C10H18.2ClH.Zn/c1-5-10(4)8-6-7-9(2)3;;;/h5,7H,6,8H2,1-4H3;2*1H;/q;;;+2/p-2/b10-5+;;;
InChIKeyIUYBJIOJYDDGOF-RWWJYAHQSA-L
XLogP5.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.55
LogP ≤ 55.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(6E)-2,6-dimethylocta-2,6-diene
CID 5365898
ethane;(6E,10Z)-2,6,10-trimethyldodeca-2,6,10-triene
CID 143275958
2,10-dimethyldodeca-2,6,10-triene
CID 123930349
(14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 131954652
(6Z,10Z,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 24871318
(10E)-2,6,11,15-tetramethylhexadeca-2,6,10,14-tetraene
CID 173158415
2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
CID 173324782
1-deuterio-3,7-dimethylocta-2,6-diene
CID 175725290
(2E,6E)-1-chloro-2,6-dimethylocta-2,6-diene
CID 13409854
(2E,6Z)-1-chloro-3,7,11-trimethyldodeca-2,6,10-triene
CID 10752589
(2E,6E,10E,14E,18E,22E,26E,30E,34E)-1-chloro-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-2,6,10,14,18,22,26,30,34,38-decaene
CID 13174780
(1E)-2,6-dimethylhepta-1,5-dien-1-ol
CID 12944525

Frequently Asked Questions

What is the IUPAC name of dichlorozinc;(6E)-2,6-dimethylocta-2,6-diene?
The IUPAC name of dichlorozinc;(6E)-2,6-dimethylocta-2,6-diene (CID 174338717) is dichlorozinc;(6E)-2,6-dimethylocta-2,6-diene.
What is the SMILES notation for dichlorozinc;(6E)-2,6-dimethylocta-2,6-diene?
The canonical SMILES for dichlorozinc;(6E)-2,6-dimethylocta-2,6-diene is C/C=C(\C)CCC=C(C)C.Cl[Zn]Cl.
What is the InChIKey of dichlorozinc;(6E)-2,6-dimethylocta-2,6-diene?
The InChIKey is IUYBJIOJYDDGOF-RWWJYAHQSA-L. The full InChI is InChI=1S/C10H18.2ClH.Zn/c1-5-10(4)8-6-7-9(2)3;;;/h5,7H,6,8H2,1-4H3;2*1H;/q;;;+2/p-2/b10-5+;;;.
What are the key properties of dichlorozinc;(6E)-2,6-dimethylocta-2,6-diene?
dichlorozinc;(6E)-2,6-dimethylocta-2,6-diene has a molecular weight of 274.55 g/mol, XLogP of 5.08, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichlorozinc;(6E)-2,6-dimethylocta-2,6-diene is sourced from PubChem (CID 174338717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).