carbanide;ethane;ethane;methane;propane;bis(tungsten(2+));hydrate

C16H52OW2 — CID 159906494

IUPACcarbanide;ethane;ethane;methane;propane;bis(tungsten(2+));hydrate
SMILESC.C.C.C.CC.CC.CCC.O.[CH2-]C.[CH3-].[CH3-].[CH3-].[W+2].[W+2]
InChIInChI=1S/C3H8.2C2H6.C2H5.4CH4.3CH3.H2O.2W/c1-3-2;3*1-2;;;;;;;;;;/h3H2,1-2H3;2*1-2H3;1H2,2H3;4*1H4;3*1H3;1H2;;/q;;;-1;;;;;3*-1;;2*+2
InChIKeyCKEKTJZDDJUVTJ-UHFFFAOYSA-N
MW628.27 g/mol
LogP7.37
Rot. Bonds

About carbanide;ethane;ethane;methane;propane;bis(tungsten(2+));hydrate

carbanide;ethane;ethane;methane;propane;bis(tungsten(2+));hydrate (PubChem CID 159906494) has the molecular formula C16H52OW2 and a molecular weight of 628.27 g/mol. Its IUPAC name is carbanide;ethane;ethane;methane;propane;bis(tungsten(2+));hydrate.

Molecular Properties

Compound Namecarbanide;ethane;ethane;methane;propane;bis(tungsten(2+));hydrate
PubChem CID159906494
Molecular FormulaC16H52OW2
Molecular Weight628.27 g/mol
Exact Mass628.30
IUPAC Namecarbanide;ethane;ethane;methane;propane;bis(tungsten(2+));hydrate
SMILESC.C.C.C.CC.CC.CCC.O.[CH2-]C.[CH3-].[CH3-].[CH3-].[W+2].[W+2]
InChIInChI=1S/C3H8.2C2H6.C2H5.4CH4.3CH3.H2O.2W/c1-3-2;3*1-2;;;;;;;;;;/h3H2,1-2H3;2*1-2H3;1H2,2H3;4*1H4;3*1H3;1H2;;/q;;;-1;;;;;3*-1;;2*+2
InChIKeyCKEKTJZDDJUVTJ-UHFFFAOYSA-N
XLogP7.37
TPSA31.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500628.27
LogP ≤ 57.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze carbanide;ethane;ethane;methane;propane;bis(tungsten(2+));hydrate 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 carbanide;ethane;ethane;methane;propane;bis(tungsten(2+));hydrate?
The IUPAC name of carbanide;ethane;ethane;methane;propane;bis(tungsten(2+));hydrate (CID 159906494) is carbanide;ethane;ethane;methane;propane;bis(tungsten(2+));hydrate.
What is the SMILES notation for carbanide;ethane;ethane;methane;propane;bis(tungsten(2+));hydrate?
The canonical SMILES for carbanide;ethane;ethane;methane;propane;bis(tungsten(2+));hydrate is C.C.C.C.CC.CC.CCC.O.[CH2-]C.[CH3-].[CH3-].[CH3-].[W+2].[W+2].
What is the InChIKey of carbanide;ethane;ethane;methane;propane;bis(tungsten(2+));hydrate?
The InChIKey is CKEKTJZDDJUVTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8.2C2H6.C2H5.4CH4.3CH3.H2O.2W/c1-3-2;3*1-2;;;;;;;;;;/h3H2,1-2H3;2*1-2H3;1H2,2H3;4*1H4;3*1H3;1H2;;/q;;;-1;;;;;3*-1;;2*+2.
What are the key properties of carbanide;ethane;ethane;methane;propane;bis(tungsten(2+));hydrate?
carbanide;ethane;ethane;methane;propane;bis(tungsten(2+));hydrate has a molecular weight of 628.27 g/mol, XLogP of 7.37, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;ethane;ethane;methane;propane;bis(tungsten(2+));hydrate is sourced from PubChem (CID 159906494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).