ethane;(6Z)-2-methyl-3-propan-2-yl-4-propylocta-2,6-diene;vanadium

C19H40V — CID 142844874

IUPACethane;(6Z)-2-methyl-3-propan-2-yl-4-propylocta-2,6-diene;vanadium
SMILESC/C=C\CC(CCC)C(=C(C)C)C(C)C.CC.CC.[V]
InChIInChI=1S/C15H28.2C2H6.V/c1-7-9-11-14(10-8-2)15(12(3)4)13(5)6;2*1-2;/h7,9,12,14H,8,10-11H2,1-6H3;2*1-2H3;/b9-7-;;;
InChIKeyGCLBONUUAUXMGV-AXXLBGQXSA-N
MW319.47 g/mol
LogP7.41
Rot. Bonds6

About ethane;(6Z)-2-methyl-3-propan-2-yl-4-propylocta-2,6-diene;vanadium

ethane;(6Z)-2-methyl-3-propan-2-yl-4-propylocta-2,6-diene;vanadium (PubChem CID 142844874) has the molecular formula C19H40V and a molecular weight of 319.47 g/mol. Its IUPAC name is ethane;(6Z)-2-methyl-3-propan-2-yl-4-propylocta-2,6-diene;vanadium.

Molecular Properties

Compound Nameethane;(6Z)-2-methyl-3-propan-2-yl-4-propylocta-2,6-diene;vanadium
PubChem CID142844874
Molecular FormulaC19H40V
Molecular Weight319.47 g/mol
Exact Mass319.26
IUPAC Nameethane;(6Z)-2-methyl-3-propan-2-yl-4-propylocta-2,6-diene;vanadium
SMILESC/C=C\CC(CCC)C(=C(C)C)C(C)C.CC.CC.[V]
InChIInChI=1S/C15H28.2C2H6.V/c1-7-9-11-14(10-8-2)15(12(3)4)13(5)6;2*1-2;/h7,9,12,14H,8,10-11H2,1-6H3;2*1-2H3;/b9-7-;;;
InChIKeyGCLBONUUAUXMGV-AXXLBGQXSA-N
XLogP7.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500319.47
LogP ≤ 57.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze ethane;(6Z)-2-methyl-3-propan-2-yl-4-propylocta-2,6-diene;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 ethane;(6Z)-2-methyl-3-propan-2-yl-4-propylocta-2,6-diene;vanadium?
The IUPAC name of ethane;(6Z)-2-methyl-3-propan-2-yl-4-propylocta-2,6-diene;vanadium (CID 142844874) is ethane;(6Z)-2-methyl-3-propan-2-yl-4-propylocta-2,6-diene;vanadium.
What is the SMILES notation for ethane;(6Z)-2-methyl-3-propan-2-yl-4-propylocta-2,6-diene;vanadium?
The canonical SMILES for ethane;(6Z)-2-methyl-3-propan-2-yl-4-propylocta-2,6-diene;vanadium is C/C=C\CC(CCC)C(=C(C)C)C(C)C.CC.CC.[V].
What is the InChIKey of ethane;(6Z)-2-methyl-3-propan-2-yl-4-propylocta-2,6-diene;vanadium?
The InChIKey is GCLBONUUAUXMGV-AXXLBGQXSA-N. The full InChI is InChI=1S/C15H28.2C2H6.V/c1-7-9-11-14(10-8-2)15(12(3)4)13(5)6;2*1-2;/h7,9,12,14H,8,10-11H2,1-6H3;2*1-2H3;/b9-7-;;;.
What are the key properties of ethane;(6Z)-2-methyl-3-propan-2-yl-4-propylocta-2,6-diene;vanadium?
ethane;(6Z)-2-methyl-3-propan-2-yl-4-propylocta-2,6-diene;vanadium has a molecular weight of 319.47 g/mol, XLogP of 7.41, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(6Z)-2-methyl-3-propan-2-yl-4-propylocta-2,6-diene;vanadium is sourced from PubChem (CID 142844874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).