magnesium;pentane;prop-1-ene

C8H16Mg — CID 19977369

IUPACmagnesium;pentane;prop-1-ene
SMILESC=C[CH2-].[CH2-]CCCC.[Mg+2]
InChIInChI=1S/C5H11.C3H5.Mg/c1-3-5-4-2;1-3-2;/h1,3-5H2,2H3;3H,1-2H2;/q2*-1;+2
InChIKeyANJRZRQKCSKTFT-UHFFFAOYSA-N
MW136.52 g/mol
LogP2.64
Rot. Bonds2

About magnesium;pentane;prop-1-ene

magnesium;pentane;prop-1-ene (PubChem CID 19977369) has the molecular formula C8H16Mg and a molecular weight of 136.52 g/mol. Its IUPAC name is magnesium;pentane;prop-1-ene.

Molecular Properties

Compound Namemagnesium;pentane;prop-1-ene
PubChem CID19977369
Molecular FormulaC8H16Mg
Molecular Weight136.52 g/mol
Exact Mass136.11
IUPAC Namemagnesium;pentane;prop-1-ene
SMILESC=C[CH2-].[CH2-]CCCC.[Mg+2]
InChIInChI=1S/C5H11.C3H5.Mg/c1-3-5-4-2;1-3-2;/h1,3-5H2,2H3;3H,1-2H2;/q2*-1;+2
InChIKeyANJRZRQKCSKTFT-UHFFFAOYSA-N
XLogP2.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.52
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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carbanide;iridium(3+);pentane
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CID 158218967
CID 158218967
carbanide;ethane;bis(pentane);bis(titanium(3+));hydrate
CID 88509419
magnesium;pentadecane;chloride
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Frequently Asked Questions

What is the IUPAC name of magnesium;pentane;prop-1-ene?
The IUPAC name of magnesium;pentane;prop-1-ene (CID 19977369) is magnesium;pentane;prop-1-ene.
What is the SMILES notation for magnesium;pentane;prop-1-ene?
The canonical SMILES for magnesium;pentane;prop-1-ene is C=C[CH2-].[CH2-]CCCC.[Mg+2].
What is the InChIKey of magnesium;pentane;prop-1-ene?
The InChIKey is ANJRZRQKCSKTFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11.C3H5.Mg/c1-3-5-4-2;1-3-2;/h1,3-5H2,2H3;3H,1-2H2;/q2*-1;+2.
What are the key properties of magnesium;pentane;prop-1-ene?
magnesium;pentane;prop-1-ene has a molecular weight of 136.52 g/mol, XLogP of 2.64, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;pentane;prop-1-ene is sourced from PubChem (CID 19977369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).