anthracene;vanadium

C28H20V — CID 173418141

IUPACanthracene;vanadium
SMILES[V].c1ccc2cc3ccccc3cc2c1.c1ccc2cc3ccccc3cc2c1
InChIInChI=1S/2C14H10.V/c2*1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1;/h2*1-10H;
InChIKeyOFDLEYXKAQKHAT-UHFFFAOYSA-N
MW407.41 g/mol
LogP7.98
Rot. Bonds

About anthracene;vanadium

anthracene;vanadium (PubChem CID 173418141) has the molecular formula C28H20V and a molecular weight of 407.41 g/mol. Its IUPAC name is anthracene;vanadium.

Molecular Properties

Compound Nameanthracene;vanadium
PubChem CID173418141
Molecular FormulaC28H20V
Molecular Weight407.41 g/mol
Exact Mass407.10
IUPAC Nameanthracene;vanadium
SMILES[V].c1ccc2cc3ccccc3cc2c1.c1ccc2cc3ccccc3cc2c1
InChIInChI=1S/2C14H10.V/c2*1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1;/h2*1-10H;
InChIKeyOFDLEYXKAQKHAT-UHFFFAOYSA-N
XLogP7.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500407.41
LogP ≤ 57.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of anthracene;vanadium?
The IUPAC name of anthracene;vanadium (CID 173418141) is anthracene;vanadium.
What is the SMILES notation for anthracene;vanadium?
The canonical SMILES for anthracene;vanadium is [V].c1ccc2cc3ccccc3cc2c1.c1ccc2cc3ccccc3cc2c1.
What is the InChIKey of anthracene;vanadium?
The InChIKey is OFDLEYXKAQKHAT-UHFFFAOYSA-N. The full InChI is InChI=1S/2C14H10.V/c2*1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1;/h2*1-10H;.
What are the key properties of anthracene;vanadium?
anthracene;vanadium has a molecular weight of 407.41 g/mol, XLogP of 7.98, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for anthracene;vanadium is sourced from PubChem (CID 173418141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).