ethane;methylcyclopentane;trifluoromethylbenzene

C15H23F3 — CID 143867816

IUPACethane;methylcyclopentane;trifluoromethylbenzene
SMILESCC.CC1CCCC1.FC(F)(F)c1ccccc1
InChIInChI=1S/C7H5F3.C6H12.C2H6/c8-7(9,10)6-4-2-1-3-5-6;1-6-4-2-3-5-6;1-2/h1-5H;6H,2-5H2,1H3;1-2H3
InChIKeyYCDHWGPFPZUEGQ-UHFFFAOYSA-N
MW260.34 g/mol
LogP5.93
Rot. Bonds

About ethane;methylcyclopentane;trifluoromethylbenzene

ethane;methylcyclopentane;trifluoromethylbenzene (PubChem CID 143867816) has the molecular formula C15H23F3 and a molecular weight of 260.34 g/mol. Its IUPAC name is ethane;methylcyclopentane;trifluoromethylbenzene.

Molecular Properties

Compound Nameethane;methylcyclopentane;trifluoromethylbenzene
PubChem CID143867816
Molecular FormulaC15H23F3
Molecular Weight260.34 g/mol
Exact Mass260.18
IUPAC Nameethane;methylcyclopentane;trifluoromethylbenzene
SMILESCC.CC1CCCC1.FC(F)(F)c1ccccc1
InChIInChI=1S/C7H5F3.C6H12.C2H6/c8-7(9,10)6-4-2-1-3-5-6;1-6-4-2-3-5-6;1-2/h1-5H;6H,2-5H2,1H3;1-2H3
InChIKeyYCDHWGPFPZUEGQ-UHFFFAOYSA-N
XLogP5.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500260.34
LogP ≤ 55.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of ethane;methylcyclopentane;trifluoromethylbenzene?
The IUPAC name of ethane;methylcyclopentane;trifluoromethylbenzene (CID 143867816) is ethane;methylcyclopentane;trifluoromethylbenzene.
What is the SMILES notation for ethane;methylcyclopentane;trifluoromethylbenzene?
The canonical SMILES for ethane;methylcyclopentane;trifluoromethylbenzene is CC.CC1CCCC1.FC(F)(F)c1ccccc1.
What is the InChIKey of ethane;methylcyclopentane;trifluoromethylbenzene?
The InChIKey is YCDHWGPFPZUEGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F3.C6H12.C2H6/c8-7(9,10)6-4-2-1-3-5-6;1-6-4-2-3-5-6;1-2/h1-5H;6H,2-5H2,1H3;1-2H3.
What are the key properties of ethane;methylcyclopentane;trifluoromethylbenzene?
ethane;methylcyclopentane;trifluoromethylbenzene has a molecular weight of 260.34 g/mol, XLogP of 5.93, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;methylcyclopentane;trifluoromethylbenzene is sourced from PubChem (CID 143867816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).