pentalene;vanadium

C8H6V — CID 161032270

IUPACpentalene;vanadium
SMILESC1=CC2=CC=CC2=C1.[V]
InChIInChI=1S/C8H6.V/c1-3-7-5-2-6-8(7)4-1;/h1-6H;
InChIKeyTZTVNTKIUCXKRF-UHFFFAOYSA-N
MW153.08 g/mol
LogP1.98
Rot. Bonds

About pentalene;vanadium

pentalene;vanadium (PubChem CID 161032270) has the molecular formula C8H6V and a molecular weight of 153.08 g/mol. Its IUPAC name is pentalene;vanadium.

Molecular Properties

Compound Namepentalene;vanadium
PubChem CID161032270
Molecular FormulaC8H6V
Molecular Weight153.08 g/mol
Exact Mass152.99
IUPAC Namepentalene;vanadium
SMILESC1=CC2=CC=CC2=C1.[V]
InChIInChI=1S/C8H6.V/c1-3-7-5-2-6-8(7)4-1;/h1-6H;
InChIKeyTZTVNTKIUCXKRF-UHFFFAOYSA-N
XLogP1.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.08
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze pentalene;vanadium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of pentalene;vanadium?
The IUPAC name of pentalene;vanadium (CID 161032270) is pentalene;vanadium.
What is the SMILES notation for pentalene;vanadium?
The canonical SMILES for pentalene;vanadium is C1=CC2=CC=CC2=C1.[V].
What is the InChIKey of pentalene;vanadium?
The InChIKey is TZTVNTKIUCXKRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6.V/c1-3-7-5-2-6-8(7)4-1;/h1-6H;.
What are the key properties of pentalene;vanadium?
pentalene;vanadium has a molecular weight of 153.08 g/mol, XLogP of 1.98, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for pentalene;vanadium is sourced from PubChem (CID 161032270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).