sodium;zinc;oct-1-ene;dichloride

C8H15Cl2NaZn — CID 158107549

IUPACsodium;zinc;oct-1-ene;dichloride
SMILES[Cl-].[Cl-].[H]/[C-]=C\CCCCCC.[Na+].[Zn+2]
InChIInChI=1S/C8H15.2ClH.Na.Zn/c1-3-5-7-8-6-4-2;;;;/h1,3H,4-8H2,2H3;2*1H;;/q-1;;;+1;+2/p-2
InChIKeyBBDORHFYIDPMAE-UHFFFAOYSA-L
MW270.49 g/mol
LogP-6.04
Rot. Bonds5

About sodium;zinc;oct-1-ene;dichloride

sodium;zinc;oct-1-ene;dichloride (PubChem CID 158107549) has the molecular formula C8H15Cl2NaZn and a molecular weight of 270.49 g/mol. Its IUPAC name is sodium;zinc;oct-1-ene;dichloride.

Molecular Properties

Compound Namesodium;zinc;oct-1-ene;dichloride
PubChem CID158107549
Molecular FormulaC8H15Cl2NaZn
Molecular Weight270.49 g/mol
Exact Mass267.97
IUPAC Namesodium;zinc;oct-1-ene;dichloride
SMILES[Cl-].[Cl-].[H]/[C-]=C\CCCCCC.[Na+].[Zn+2]
InChIInChI=1S/C8H15.2ClH.Na.Zn/c1-3-5-7-8-6-4-2;;;;/h1,3H,4-8H2,2H3;2*1H;;/q-1;;;+1;+2/p-2
InChIKeyBBDORHFYIDPMAE-UHFFFAOYSA-L
XLogP-6.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.49
LogP ≤ 5-6.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

magnesium;hex-1-ene;bromide
CID 12590026
undecane chloride
CID 19736895
disodium;hydride;(Z)-octadec-9-ene
CID 173005527
nonacos-6-ene
CID 25200821
(E)-hexadec-6-ene
CID 5352260
(Z)-docos-9-ene
CID 11690102
(E)-hexacos-10-ene
CID 22172169
(E)-nonacos-10-ene
CID 14367300
triacont-12-ene
CID 54535715
(Z)-octadec-6-ene
CID 5352239
(24Z)-hexatriaconta-9,24-diene
CID 173127472
(Z)-heptacos-11-ene
CID 56936074

Frequently Asked Questions

What is the IUPAC name of sodium;zinc;oct-1-ene;dichloride?
The IUPAC name of sodium;zinc;oct-1-ene;dichloride (CID 158107549) is sodium;zinc;oct-1-ene;dichloride.
What is the SMILES notation for sodium;zinc;oct-1-ene;dichloride?
The canonical SMILES for sodium;zinc;oct-1-ene;dichloride is [Cl-].[Cl-].[H]/[C-]=C\CCCCCC.[Na+].[Zn+2].
What is the InChIKey of sodium;zinc;oct-1-ene;dichloride?
The InChIKey is BBDORHFYIDPMAE-UHFFFAOYSA-L. The full InChI is InChI=1S/C8H15.2ClH.Na.Zn/c1-3-5-7-8-6-4-2;;;;/h1,3H,4-8H2,2H3;2*1H;;/q-1;;;+1;+2/p-2.
What are the key properties of sodium;zinc;oct-1-ene;dichloride?
sodium;zinc;oct-1-ene;dichloride has a molecular weight of 270.49 g/mol, XLogP of -6.04, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;zinc;oct-1-ene;dichloride is sourced from PubChem (CID 158107549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).