carbanide;propan-2-one;vanadium(2+)

C4H8OV — CID 153454963

IUPACcarbanide;propan-2-one;vanadium(2+)
SMILES[CH2-]C(C)=O.[CH3-].[V+2]
InChIInChI=1S/C3H5O.CH3.V/c1-3(2)4;;/h1H2,2H3;1H3;/q2*-1;+2
InChIKeyDISMZAVXNTWSQC-UHFFFAOYSA-N
MW123.05 g/mol
LogP0.86
Rot. Bonds

About carbanide;propan-2-one;vanadium(2+)

carbanide;propan-2-one;vanadium(2+) (PubChem CID 153454963) has the molecular formula C4H8OV and a molecular weight of 123.05 g/mol. Its IUPAC name is carbanide;propan-2-one;vanadium(2+).

Molecular Properties

Compound Namecarbanide;propan-2-one;vanadium(2+)
PubChem CID153454963
Molecular FormulaC4H8OV
Molecular Weight123.05 g/mol
Exact Mass123.00
IUPAC Namecarbanide;propan-2-one;vanadium(2+)
SMILES[CH2-]C(C)=O.[CH3-].[V+2]
InChIInChI=1S/C3H5O.CH3.V/c1-3(2)4;;/h1H2,2H3;1H3;/q2*-1;+2
InChIKeyDISMZAVXNTWSQC-UHFFFAOYSA-N
XLogP0.86
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.05
LogP ≤ 50.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 carbanide;propan-2-one;vanadium(2+)?
The IUPAC name of carbanide;propan-2-one;vanadium(2+) (CID 153454963) is carbanide;propan-2-one;vanadium(2+).
What is the SMILES notation for carbanide;propan-2-one;vanadium(2+)?
The canonical SMILES for carbanide;propan-2-one;vanadium(2+) is [CH2-]C(C)=O.[CH3-].[V+2].
What is the InChIKey of carbanide;propan-2-one;vanadium(2+)?
The InChIKey is DISMZAVXNTWSQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5O.CH3.V/c1-3(2)4;;/h1H2,2H3;1H3;/q2*-1;+2.
What are the key properties of carbanide;propan-2-one;vanadium(2+)?
carbanide;propan-2-one;vanadium(2+) has a molecular weight of 123.05 g/mol, XLogP of 0.86, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;propan-2-one;vanadium(2+) is sourced from PubChem (CID 153454963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).