magnesium;1-propan-2-ylbicyclo[2.2.1]heptane;chloride

C10H17ClMg — CID 153327753

IUPACmagnesium;1-propan-2-ylbicyclo[2.2.1]heptane;chloride
SMILESC[C-](C)C12CCC(CC1)C2.[Cl-].[Mg+2]
InChIInChI=1S/C10H17.ClH.Mg/c1-8(2)10-5-3-9(7-10)4-6-10;;/h9H,3-7H2,1-2H3;1H;/q-1;;+2/p-1
InChIKeyBJARCYBSOUXOIB-UHFFFAOYSA-M
MW197.00 g/mol
LogP-0.20
Rot. Bonds1

About magnesium;1-propan-2-ylbicyclo[2.2.1]heptane;chloride

magnesium;1-propan-2-ylbicyclo[2.2.1]heptane;chloride (PubChem CID 153327753) has the molecular formula C10H17ClMg and a molecular weight of 197.00 g/mol. Its IUPAC name is magnesium;1-propan-2-ylbicyclo[2.2.1]heptane;chloride.

Molecular Properties

Compound Namemagnesium;1-propan-2-ylbicyclo[2.2.1]heptane;chloride
PubChem CID153327753
Molecular FormulaC10H17ClMg
Molecular Weight197.00 g/mol
Exact Mass196.09
IUPAC Namemagnesium;1-propan-2-ylbicyclo[2.2.1]heptane;chloride
SMILESC[C-](C)C12CCC(CC1)C2.[Cl-].[Mg+2]
InChIInChI=1S/C10H17.ClH.Mg/c1-8(2)10-5-3-9(7-10)4-6-10;;/h9H,3-7H2,1-2H3;1H;/q-1;;+2/p-1
InChIKeyBJARCYBSOUXOIB-UHFFFAOYSA-M
XLogP-0.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.00
LogP ≤ 5-0.20
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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Frequently Asked Questions

What is the IUPAC name of magnesium;1-propan-2-ylbicyclo[2.2.1]heptane;chloride?
The IUPAC name of magnesium;1-propan-2-ylbicyclo[2.2.1]heptane;chloride (CID 153327753) is magnesium;1-propan-2-ylbicyclo[2.2.1]heptane;chloride.
What is the SMILES notation for magnesium;1-propan-2-ylbicyclo[2.2.1]heptane;chloride?
The canonical SMILES for magnesium;1-propan-2-ylbicyclo[2.2.1]heptane;chloride is C[C-](C)C12CCC(CC1)C2.[Cl-].[Mg+2].
What is the InChIKey of magnesium;1-propan-2-ylbicyclo[2.2.1]heptane;chloride?
The InChIKey is BJARCYBSOUXOIB-UHFFFAOYSA-M. The full InChI is InChI=1S/C10H17.ClH.Mg/c1-8(2)10-5-3-9(7-10)4-6-10;;/h9H,3-7H2,1-2H3;1H;/q-1;;+2/p-1.
What are the key properties of magnesium;1-propan-2-ylbicyclo[2.2.1]heptane;chloride?
magnesium;1-propan-2-ylbicyclo[2.2.1]heptane;chloride has a molecular weight of 197.00 g/mol, XLogP of -0.20, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;1-propan-2-ylbicyclo[2.2.1]heptane;chloride is sourced from PubChem (CID 153327753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).