1,2,3,5,5-pentamethylcyclopenta-1,3-diene;vanadium(2+);dichloride

C10H15Cl2V- — CID 18368708

IUPAC1,2,3,5,5-pentamethylcyclopenta-1,3-diene;vanadium(2+);dichloride
SMILESCC1=[C-]C(C)(C)C(C)=C1C.[Cl-].[Cl-].[V+2]
InChIInChI=1S/C10H15.2ClH.V/c1-7-6-10(4,5)9(3)8(7)2;;;/h1-5H3;2*1H;/q-1;;;+2/p-2
InChIKeyYXKAYRAZUYVRNM-UHFFFAOYSA-L
MW257.08 g/mol
LogP-2.88
Rot. Bonds

About 1,2,3,5,5-pentamethylcyclopenta-1,3-diene;vanadium(2+);dichloride

1,2,3,5,5-pentamethylcyclopenta-1,3-diene;vanadium(2+);dichloride (PubChem CID 18368708) has the molecular formula C10H15Cl2V- and a molecular weight of 257.08 g/mol. Its IUPAC name is 1,2,3,5,5-pentamethylcyclopenta-1,3-diene;vanadium(2+);dichloride.

Molecular Properties

Compound Name1,2,3,5,5-pentamethylcyclopenta-1,3-diene;vanadium(2+);dichloride
PubChem CID18368708
Molecular FormulaC10H15Cl2V-
Molecular Weight257.08 g/mol
Exact Mass256.00
IUPAC Name1,2,3,5,5-pentamethylcyclopenta-1,3-diene;vanadium(2+);dichloride
SMILESCC1=[C-]C(C)(C)C(C)=C1C.[Cl-].[Cl-].[V+2]
InChIInChI=1S/C10H15.2ClH.V/c1-7-6-10(4,5)9(3)8(7)2;;;/h1-5H3;2*1H;/q-1;;;+2/p-2
InChIKeyYXKAYRAZUYVRNM-UHFFFAOYSA-L
XLogP-2.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.08
LogP ≤ 5-2.88
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 1,2,3,5,5-pentamethylcyclopenta-1,3-diene;vanadium(2+);dichloride?
The IUPAC name of 1,2,3,5,5-pentamethylcyclopenta-1,3-diene;vanadium(2+);dichloride (CID 18368708) is 1,2,3,5,5-pentamethylcyclopenta-1,3-diene;vanadium(2+);dichloride.
What is the SMILES notation for 1,2,3,5,5-pentamethylcyclopenta-1,3-diene;vanadium(2+);dichloride?
The canonical SMILES for 1,2,3,5,5-pentamethylcyclopenta-1,3-diene;vanadium(2+);dichloride is CC1=[C-]C(C)(C)C(C)=C1C.[Cl-].[Cl-].[V+2].
What is the InChIKey of 1,2,3,5,5-pentamethylcyclopenta-1,3-diene;vanadium(2+);dichloride?
The InChIKey is YXKAYRAZUYVRNM-UHFFFAOYSA-L. The full InChI is InChI=1S/C10H15.2ClH.V/c1-7-6-10(4,5)9(3)8(7)2;;;/h1-5H3;2*1H;/q-1;;;+2/p-2.
What are the key properties of 1,2,3,5,5-pentamethylcyclopenta-1,3-diene;vanadium(2+);dichloride?
1,2,3,5,5-pentamethylcyclopenta-1,3-diene;vanadium(2+);dichloride has a molecular weight of 257.08 g/mol, XLogP of -2.88, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,5,5-pentamethylcyclopenta-1,3-diene;vanadium(2+);dichloride is sourced from PubChem (CID 18368708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).