5-ethyl-2-methylcyclopenta-1,3-diene;vanadium

C8H11V- — CID 154419789

IUPAC5-ethyl-2-methylcyclopenta-1,3-diene;vanadium
SMILESCC[c-]1ccc(C)c1.[V]
InChIInChI=1S/C8H11.V/c1-3-8-5-4-7(2)6-8;/h4-6H,3H2,1-2H3;/q-1;
InChIKeyDDJVWTZEGPJOQK-UHFFFAOYSA-N
MW158.12 g/mol
LogP2.27
Rot. Bonds1

About 5-ethyl-2-methylcyclopenta-1,3-diene;vanadium

5-ethyl-2-methylcyclopenta-1,3-diene;vanadium (PubChem CID 154419789) has the molecular formula C8H11V- and a molecular weight of 158.12 g/mol. Its IUPAC name is 5-ethyl-2-methylcyclopenta-1,3-diene;vanadium.

Molecular Properties

Compound Name5-ethyl-2-methylcyclopenta-1,3-diene;vanadium
PubChem CID154419789
Molecular FormulaC8H11V-
Molecular Weight158.12 g/mol
Exact Mass158.03
IUPAC Name5-ethyl-2-methylcyclopenta-1,3-diene;vanadium
SMILESCC[c-]1ccc(C)c1.[V]
InChIInChI=1S/C8H11.V/c1-3-8-5-4-7(2)6-8;/h4-6H,3H2,1-2H3;/q-1;
InChIKeyDDJVWTZEGPJOQK-UHFFFAOYSA-N
XLogP2.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.12
LogP ≤ 52.27
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 5-ethyl-2-methylcyclopenta-1,3-diene;vanadium?
The IUPAC name of 5-ethyl-2-methylcyclopenta-1,3-diene;vanadium (CID 154419789) is 5-ethyl-2-methylcyclopenta-1,3-diene;vanadium.
What is the SMILES notation for 5-ethyl-2-methylcyclopenta-1,3-diene;vanadium?
The canonical SMILES for 5-ethyl-2-methylcyclopenta-1,3-diene;vanadium is CC[c-]1ccc(C)c1.[V].
What is the InChIKey of 5-ethyl-2-methylcyclopenta-1,3-diene;vanadium?
The InChIKey is DDJVWTZEGPJOQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11.V/c1-3-8-5-4-7(2)6-8;/h4-6H,3H2,1-2H3;/q-1;.
What are the key properties of 5-ethyl-2-methylcyclopenta-1,3-diene;vanadium?
5-ethyl-2-methylcyclopenta-1,3-diene;vanadium has a molecular weight of 158.12 g/mol, XLogP of 2.27, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-methylcyclopenta-1,3-diene;vanadium is sourced from PubChem (CID 154419789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).