CID 134897671

C8H11Li — CID 134897671

IUPAC—
SMILES[C-]1=C2CCCCCC12.[Li+]
InChIInChI=1S/C8H11.Li/c1-2-4-7-6-8(7)5-3-1;/h7H,1-5H2;/q-1;+1
InChIKeyNVAHCHVWJCZTRT-UHFFFAOYSA-N
MW114.12 g/mol
LogP-0.69
Rot. Bonds

About CID 134897671

CID 134897671 (PubChem CID 134897671) has the molecular formula C8H11Li and a molecular weight of 114.12 g/mol.

Molecular Properties

Compound NameCID 134897671
PubChem CID134897671
Molecular FormulaC8H11Li
Molecular Weight114.12 g/mol
Exact Mass114.10
IUPAC Name—
SMILES[C-]1=C2CCCCCC12.[Li+]
InChIInChI=1S/C8H11.Li/c1-2-4-7-6-8(7)5-3-1;/h7H,1-5H2;/q-1;+1
InChIKeyNVAHCHVWJCZTRT-UHFFFAOYSA-N
XLogP-0.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.12
LogP ≤ 5-0.69
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 CID 134897671?
The IUPAC name of CID 134897671 (CID 134897671) is not available.
What is the SMILES notation for CID 134897671?
The canonical SMILES for CID 134897671 is [C-]1=C2CCCCCC12.[Li+].
What is the InChIKey of CID 134897671?
The InChIKey is NVAHCHVWJCZTRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11.Li/c1-2-4-7-6-8(7)5-3-1;/h7H,1-5H2;/q-1;+1.
What are the key properties of CID 134897671?
CID 134897671 has a molecular weight of 114.12 g/mol, XLogP of -0.69, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134897671 is sourced from PubChem (CID 134897671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).