CID 158218967

C16H34Mg2 — CID 158218967

IUPAC—
SMILES[CH2-]CCCCCCC.[CH2-]CCCCCCC.[Mg+2].[Mg]
InChIInChI=1S/2C8H17.2Mg/c2*1-3-5-7-8-6-4-2;;/h2*1,3-8H2,2H3;;/q2*-1;;+2
InChIKeyAGAWBJZUXDIGFD-UHFFFAOYSA-N
MW275.06 g/mol
LogP5.60
Rot. Bonds10

About CID 158218967

CID 158218967 (PubChem CID 158218967) has the molecular formula C16H34Mg2 and a molecular weight of 275.06 g/mol.

Molecular Properties

Compound NameCID 158218967
PubChem CID158218967
Molecular FormulaC16H34Mg2
Molecular Weight275.06 g/mol
Exact Mass274.24
IUPAC Name—
SMILES[CH2-]CCCCCCC.[CH2-]CCCCCCC.[Mg+2].[Mg]
InChIInChI=1S/2C8H17.2Mg/c2*1-3-5-7-8-6-4-2;;/h2*1,3-8H2,2H3;;/q2*-1;;+2
InChIKeyAGAWBJZUXDIGFD-UHFFFAOYSA-N
XLogP5.60
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500275.06
LogP ≤ 55.60
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'}

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Related Compounds

magnesium;octane;propane
CID 140617216
magnesium;octadecane;bromide
CID 12546206
magnesium;pentadecane;chloride
CID 88592756
heptadecane
CID 156905849
heptane;iodomanganese(1+)
CID 12512202
magnesium;octane;propane
CID 140617215
magnesium;butane;octane;hydrochloride
CID 87898861
cerium;dodecane
CID 154114371
tris(heptane);vanadium
CID 59340167
zinc heptane
CID 4204916
dodecane;zirconium
CID 148549415
tetrakis(dodecane);zirconium(4+)
CID 173426195

Frequently Asked Questions

What is the IUPAC name of CID 158218967?
The IUPAC name of CID 158218967 (CID 158218967) is not available.
What is the SMILES notation for CID 158218967?
The canonical SMILES for CID 158218967 is [CH2-]CCCCCCC.[CH2-]CCCCCCC.[Mg+2].[Mg].
What is the InChIKey of CID 158218967?
The InChIKey is AGAWBJZUXDIGFD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H17.2Mg/c2*1-3-5-7-8-6-4-2;;/h2*1,3-8H2,2H3;;/q2*-1;;+2.
What are the key properties of CID 158218967?
CID 158218967 has a molecular weight of 275.06 g/mol, XLogP of 5.60, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 158218967 is sourced from PubChem (CID 158218967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).