hex-1-ene;zinc

C6H12Zn — CID 174554611

IUPAChex-1-ene;zinc
SMILESC=CCCCC.[Zn]
InChIInChI=1S/C6H12.Zn/c1-3-5-6-4-2;/h3H,1,4-6H2,2H3;
InChIKeyHNRJMYQBTKOVNH-UHFFFAOYSA-N
MW149.55 g/mol
LogP2.36
Rot. Bonds3

About hex-1-ene;zinc

hex-1-ene;zinc (PubChem CID 174554611) has the molecular formula C6H12Zn and a molecular weight of 149.55 g/mol. Its IUPAC name is hex-1-ene;zinc.

Molecular Properties

Compound Namehex-1-ene;zinc
PubChem CID174554611
Molecular FormulaC6H12Zn
Molecular Weight149.55 g/mol
Exact Mass148.02
IUPAC Namehex-1-ene;zinc
SMILESC=CCCCC.[Zn]
InChIInChI=1S/C6H12.Zn/c1-3-5-6-4-2;/h3H,1,4-6H2,2H3;
InChIKeyHNRJMYQBTKOVNH-UHFFFAOYSA-N
XLogP2.36
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.55
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

but-1-ene;tetrakis(hex-1-ene)
CID 22000755
hex-1-ene;zirconium(4+);dichloride
CID 157382882
but-1-ene;hexakis(hex-1-ene)
CID 161273113
(Z)-dec-5-ene;hex-1-ene
CID 141304086
benzene;buta-1,3-diene;hex-1-ene
CID 159461110
but-1-ene;hex-1-ene;prop-1-ene
CID 86759030
ethanamine;hex-1-ene;hydrochloride
CID 160582702
non-1-ene
CID 141296734
hexane;octadec-1-ene
CID 175577514
octadeca-1,17-diene;tetradec-1-ene
CID 173070986
dec-1-ene;dodec-1-ene;tetradec-1-ene
CID 159177706
octadec-1-ene;tetradec-1-ene
CID 158470925

Frequently Asked Questions

What is the IUPAC name of hex-1-ene;zinc?
The IUPAC name of hex-1-ene;zinc (CID 174554611) is hex-1-ene;zinc.
What is the SMILES notation for hex-1-ene;zinc?
The canonical SMILES for hex-1-ene;zinc is C=CCCCC.[Zn].
What is the InChIKey of hex-1-ene;zinc?
The InChIKey is HNRJMYQBTKOVNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12.Zn/c1-3-5-6-4-2;/h3H,1,4-6H2,2H3;.
What are the key properties of hex-1-ene;zinc?
hex-1-ene;zinc has a molecular weight of 149.55 g/mol, XLogP of 2.36, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for hex-1-ene;zinc is sourced from PubChem (CID 174554611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).