carbanide;2-(difluoromethoxy)-1-(fluoromethoxy)-3,5-dimethylbenzene-6-ide;tungsten(2+)

C11H13F3O2W — CID 59592269

IUPACcarbanide;2-(difluoromethoxy)-1-(fluoromethoxy)-3,5-dimethylbenzene-6-ide;tungsten(2+)
SMILESCc1[c-]c(OCF)c(OC(F)F)c(C)c1.[CH3-].[W+2]
InChIInChI=1S/C10H10F3O2.CH3.W/c1-6-3-7(2)9(15-10(12)13)8(4-6)14-5-11;;/h3,10H,5H2,1-2H3;1H3;/q2*-1;+2
InChIKeyBVJVGKCAIXFOEB-UHFFFAOYSA-N
MW418.06 g/mol
LogP3.46
Rot. Bonds4

About carbanide;2-(difluoromethoxy)-1-(fluoromethoxy)-3,5-dimethylbenzene-6-ide;tungsten(2+)

carbanide;2-(difluoromethoxy)-1-(fluoromethoxy)-3,5-dimethylbenzene-6-ide;tungsten(2+) (PubChem CID 59592269) has the molecular formula C11H13F3O2W and a molecular weight of 418.06 g/mol. Its IUPAC name is carbanide;2-(difluoromethoxy)-1-(fluoromethoxy)-3,5-dimethylbenzene-6-ide;tungsten(2+).

Molecular Properties

Compound Namecarbanide;2-(difluoromethoxy)-1-(fluoromethoxy)-3,5-dimethylbenzene-6-ide;tungsten(2+)
PubChem CID59592269
Molecular FormulaC11H13F3O2W
Molecular Weight418.06 g/mol
Exact Mass418.04
IUPAC Namecarbanide;2-(difluoromethoxy)-1-(fluoromethoxy)-3,5-dimethylbenzene-6-ide;tungsten(2+)
SMILESCc1[c-]c(OCF)c(OC(F)F)c(C)c1.[CH3-].[W+2]
InChIInChI=1S/C10H10F3O2.CH3.W/c1-6-3-7(2)9(15-10(12)13)8(4-6)14-5-11;;/h3,10H,5H2,1-2H3;1H3;/q2*-1;+2
InChIKeyBVJVGKCAIXFOEB-UHFFFAOYSA-N
XLogP3.46
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.06
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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;2-(difluoromethoxy)-1-(fluoromethoxy)-3,5-dimethylbenzene-6-ide;tungsten(2+)?
The IUPAC name of carbanide;2-(difluoromethoxy)-1-(fluoromethoxy)-3,5-dimethylbenzene-6-ide;tungsten(2+) (CID 59592269) is carbanide;2-(difluoromethoxy)-1-(fluoromethoxy)-3,5-dimethylbenzene-6-ide;tungsten(2+).
What is the SMILES notation for carbanide;2-(difluoromethoxy)-1-(fluoromethoxy)-3,5-dimethylbenzene-6-ide;tungsten(2+)?
The canonical SMILES for carbanide;2-(difluoromethoxy)-1-(fluoromethoxy)-3,5-dimethylbenzene-6-ide;tungsten(2+) is Cc1[c-]c(OCF)c(OC(F)F)c(C)c1.[CH3-].[W+2].
What is the InChIKey of carbanide;2-(difluoromethoxy)-1-(fluoromethoxy)-3,5-dimethylbenzene-6-ide;tungsten(2+)?
The InChIKey is BVJVGKCAIXFOEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3O2.CH3.W/c1-6-3-7(2)9(15-10(12)13)8(4-6)14-5-11;;/h3,10H,5H2,1-2H3;1H3;/q2*-1;+2.
What are the key properties of carbanide;2-(difluoromethoxy)-1-(fluoromethoxy)-3,5-dimethylbenzene-6-ide;tungsten(2+)?
carbanide;2-(difluoromethoxy)-1-(fluoromethoxy)-3,5-dimethylbenzene-6-ide;tungsten(2+) has a molecular weight of 418.06 g/mol, XLogP of 3.46, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;2-(difluoromethoxy)-1-(fluoromethoxy)-3,5-dimethylbenzene-6-ide;tungsten(2+) is sourced from PubChem (CID 59592269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).