magnesium;(Z)-non-3-ene;dichloride

C9H18Cl2Mg — CID 174157517

IUPACmagnesium;(Z)-non-3-ene;dichloride
SMILESCC/C=C\CCCCC.[Cl-].[Cl-].[Mg+2]
InChIInChI=1S/C9H18.2ClH.Mg/c1-3-5-7-9-8-6-4-2;;;/h5,7H,3-4,6,8-9H2,1-2H3;2*1H;/q;;;+2/p-2/b7-5-;;;
InChIKeyBMHGOGJRLGGVBW-PQIWAGTOSA-L
MW221.45 g/mol
LogP-2.84
Rot. Bonds5

About magnesium;(Z)-non-3-ene;dichloride

magnesium;(Z)-non-3-ene;dichloride (PubChem CID 174157517) has the molecular formula C9H18Cl2Mg and a molecular weight of 221.45 g/mol. Its IUPAC name is magnesium;(Z)-non-3-ene;dichloride.

Molecular Properties

Compound Namemagnesium;(Z)-non-3-ene;dichloride
PubChem CID174157517
Molecular FormulaC9H18Cl2Mg
Molecular Weight221.45 g/mol
Exact Mass220.06
IUPAC Namemagnesium;(Z)-non-3-ene;dichloride
SMILESCC/C=C\CCCCC.[Cl-].[Cl-].[Mg+2]
InChIInChI=1S/C9H18.2ClH.Mg/c1-3-5-7-9-8-6-4-2;;;/h5,7H,3-4,6,8-9H2,1-2H3;2*1H;/q;;;+2/p-2/b7-5-;;;
InChIKeyBMHGOGJRLGGVBW-PQIWAGTOSA-L
XLogP-2.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.45
LogP ≤ 5-2.84
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

(E)-non-3-ene
CID 5364445
(E)-nonacos-3-ene
CID 22172230
(3Z,11Z)-heptadeca-3,11-diene
CID 91750518
octacos-3-ene
CID 54171253
(Z)-tridec-3-ene
CID 5362711
(E)-octadec-3-ene
CID 5365984
(E)-heptadec-3-ene
CID 5352250
(3E,13E)-nonadeca-3,13-diene
CID 141029609
henicosa-3,6-diene
CID 72727393
hexadeca-3,6,9-triene
CID 56627141
(3Z,12Z,15Z)-tricosa-3,12,15-triene
CID 174109859
(3Z,6Z,9Z,12Z)-henicosa-3,6,9,12-tetraene
CID 158472719

Frequently Asked Questions

What is the IUPAC name of magnesium;(Z)-non-3-ene;dichloride?
The IUPAC name of magnesium;(Z)-non-3-ene;dichloride (CID 174157517) is magnesium;(Z)-non-3-ene;dichloride.
What is the SMILES notation for magnesium;(Z)-non-3-ene;dichloride?
The canonical SMILES for magnesium;(Z)-non-3-ene;dichloride is CC/C=C\CCCCC.[Cl-].[Cl-].[Mg+2].
What is the InChIKey of magnesium;(Z)-non-3-ene;dichloride?
The InChIKey is BMHGOGJRLGGVBW-PQIWAGTOSA-L. The full InChI is InChI=1S/C9H18.2ClH.Mg/c1-3-5-7-9-8-6-4-2;;;/h5,7H,3-4,6,8-9H2,1-2H3;2*1H;/q;;;+2/p-2/b7-5-;;;.
What are the key properties of magnesium;(Z)-non-3-ene;dichloride?
magnesium;(Z)-non-3-ene;dichloride has a molecular weight of 221.45 g/mol, XLogP of -2.84, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;(Z)-non-3-ene;dichloride is sourced from PubChem (CID 174157517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).