ethane;1-fluorobutane;tris(yttrium)

C6H12FY3-3 — CID 157320924

IUPACethane;1-fluorobutane;tris(yttrium)
SMILESC[CH-]C[CH-]F.[CH2-]C.[Y].[Y].[Y]
InChIInChI=1S/C4H7F.C2H5.3Y/c1-2-3-4-5;1-2;;;/h2,4H,3H2,1H3;1H2,2H3;;;/q-2;-1;;;
InChIKeyHASXUBPUYZEQMB-UHFFFAOYSA-N
MW369.88 g/mol
LogP2.56
Rot. Bonds2

About ethane;1-fluorobutane;tris(yttrium)

ethane;1-fluorobutane;tris(yttrium) (PubChem CID 157320924) has the molecular formula C6H12FY3-3 and a molecular weight of 369.88 g/mol. Its IUPAC name is ethane;1-fluorobutane;tris(yttrium).

Molecular Properties

Compound Nameethane;1-fluorobutane;tris(yttrium)
PubChem CID157320924
Molecular FormulaC6H12FY3-3
Molecular Weight369.88 g/mol
Exact Mass369.81
IUPAC Nameethane;1-fluorobutane;tris(yttrium)
SMILESC[CH-]C[CH-]F.[CH2-]C.[Y].[Y].[Y]
InChIInChI=1S/C4H7F.C2H5.3Y/c1-2-3-4-5;1-2;;;/h2,4H,3H2,1H3;1H2,2H3;;;/q-2;-1;;;
InChIKeyHASXUBPUYZEQMB-UHFFFAOYSA-N
XLogP2.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.88
LogP ≤ 52.56
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 ethane;1-fluorobutane;tris(yttrium)?
The IUPAC name of ethane;1-fluorobutane;tris(yttrium) (CID 157320924) is ethane;1-fluorobutane;tris(yttrium).
What is the SMILES notation for ethane;1-fluorobutane;tris(yttrium)?
The canonical SMILES for ethane;1-fluorobutane;tris(yttrium) is C[CH-]C[CH-]F.[CH2-]C.[Y].[Y].[Y].
What is the InChIKey of ethane;1-fluorobutane;tris(yttrium)?
The InChIKey is HASXUBPUYZEQMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7F.C2H5.3Y/c1-2-3-4-5;1-2;;;/h2,4H,3H2,1H3;1H2,2H3;;;/q-2;-1;;;.
What are the key properties of ethane;1-fluorobutane;tris(yttrium)?
ethane;1-fluorobutane;tris(yttrium) has a molecular weight of 369.88 g/mol, XLogP of 2.56, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-fluorobutane;tris(yttrium) is sourced from PubChem (CID 157320924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).