CID 153327779

C7H11IMg — CID 153327779

IUPAC—
SMILESC1C[C-]2CC(C1)C2.[I-].[Mg+2]
InChIInChI=1S/C7H11.HI.Mg/c1-2-6-4-7(3-1)5-6;;/h6H,1-5H2;1H;/q-1;;+2/p-1
InChIKeyQWZBAHOXURPZDL-UHFFFAOYSA-M
MW246.37 g/mol
LogP-1.22
Rot. Bonds

About CID 153327779

CID 153327779 (PubChem CID 153327779) has the molecular formula C7H11IMg and a molecular weight of 246.37 g/mol.

Molecular Properties

Compound NameCID 153327779
PubChem CID153327779
Molecular FormulaC7H11IMg
Molecular Weight246.37 g/mol
Exact Mass245.98
IUPAC Name—
SMILESC1C[C-]2CC(C1)C2.[I-].[Mg+2]
InChIInChI=1S/C7H11.HI.Mg/c1-2-6-4-7(3-1)5-6;;/h6H,1-5H2;1H;/q-1;;+2/p-1
InChIKeyQWZBAHOXURPZDL-UHFFFAOYSA-M
XLogP-1.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.37
LogP ≤ 5-1.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 153327779?
The IUPAC name of CID 153327779 (CID 153327779) is not available.
What is the SMILES notation for CID 153327779?
The canonical SMILES for CID 153327779 is C1C[C-]2CC(C1)C2.[I-].[Mg+2].
What is the InChIKey of CID 153327779?
The InChIKey is QWZBAHOXURPZDL-UHFFFAOYSA-M. The full InChI is InChI=1S/C7H11.HI.Mg/c1-2-6-4-7(3-1)5-6;;/h6H,1-5H2;1H;/q-1;;+2/p-1.
What are the key properties of CID 153327779?
CID 153327779 has a molecular weight of 246.37 g/mol, XLogP of -1.22, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 153327779 is sourced from PubChem (CID 153327779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).