1-phenylprop-1-en-2-ylbenzene;pentakis(vanadium);yttrium

C15H11V5Y-3 — CID 58787392

IUPAC1-phenylprop-1-en-2-ylbenzene;pentakis(vanadium);yttrium
SMILES[CH2-]/C(=[C-]\c1ccccc1)c1[c-]cccc1.[V].[V].[V].[V].[V].[Y]
InChIInChI=1S/C15H11.5V.Y/c1-13(15-10-6-3-7-11-15)12-14-8-4-2-5-9-14;;;;;;/h2-10H,1H2;;;;;;/q-3;;;;;;
InChIKeyOPVGNQQIKMMMHI-UHFFFAOYSA-N
MW534.88 g/mol
LogP3.54
Rot. Bonds2

About 1-phenylprop-1-en-2-ylbenzene;pentakis(vanadium);yttrium

1-phenylprop-1-en-2-ylbenzene;pentakis(vanadium);yttrium (PubChem CID 58787392) has the molecular formula C15H11V5Y-3 and a molecular weight of 534.88 g/mol. Its IUPAC name is 1-phenylprop-1-en-2-ylbenzene;pentakis(vanadium);yttrium.

Molecular Properties

Compound Name1-phenylprop-1-en-2-ylbenzene;pentakis(vanadium);yttrium
PubChem CID58787392
Molecular FormulaC15H11V5Y-3
Molecular Weight534.88 g/mol
Exact Mass534.71
IUPAC Name1-phenylprop-1-en-2-ylbenzene;pentakis(vanadium);yttrium
SMILES[CH2-]/C(=[C-]\c1ccccc1)c1[c-]cccc1.[V].[V].[V].[V].[V].[Y]
InChIInChI=1S/C15H11.5V.Y/c1-13(15-10-6-3-7-11-15)12-14-8-4-2-5-9-14;;;;;;/h2-10H,1H2;;;;;;/q-3;;;;;;
InChIKeyOPVGNQQIKMMMHI-UHFFFAOYSA-N
XLogP3.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500534.88
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1-phenylprop-1-en-2-ylbenzene;pentakis(vanadium);yttrium?
The IUPAC name of 1-phenylprop-1-en-2-ylbenzene;pentakis(vanadium);yttrium (CID 58787392) is 1-phenylprop-1-en-2-ylbenzene;pentakis(vanadium);yttrium.
What is the SMILES notation for 1-phenylprop-1-en-2-ylbenzene;pentakis(vanadium);yttrium?
The canonical SMILES for 1-phenylprop-1-en-2-ylbenzene;pentakis(vanadium);yttrium is [CH2-]/C(=[C-]\c1ccccc1)c1[c-]cccc1.[V].[V].[V].[V].[V].[Y].
What is the InChIKey of 1-phenylprop-1-en-2-ylbenzene;pentakis(vanadium);yttrium?
The InChIKey is OPVGNQQIKMMMHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11.5V.Y/c1-13(15-10-6-3-7-11-15)12-14-8-4-2-5-9-14;;;;;;/h2-10H,1H2;;;;;;/q-3;;;;;;.
What are the key properties of 1-phenylprop-1-en-2-ylbenzene;pentakis(vanadium);yttrium?
1-phenylprop-1-en-2-ylbenzene;pentakis(vanadium);yttrium has a molecular weight of 534.88 g/mol, XLogP of 3.54, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenylprop-1-en-2-ylbenzene;pentakis(vanadium);yttrium is sourced from PubChem (CID 58787392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).