chloroform;1,2,3,4,5,6-hexafluorobenzene

C7HCl3F6 — CID 88844681

IUPACchloroform;1,2,3,4,5,6-hexafluorobenzene
SMILESClC(Cl)Cl.Fc1c(F)c(F)c(F)c(F)c1F
InChIInChI=1S/C6F6.CHCl3/c7-1-2(8)4(10)6(12)5(11)3(1)9;2-1(3)4/h;1H
InChIKeySKZLYOBYEQTZSY-UHFFFAOYSA-N
MW305.43 g/mol
LogP4.51
Rot. Bonds

About chloroform;1,2,3,4,5,6-hexafluorobenzene

chloroform;1,2,3,4,5,6-hexafluorobenzene (PubChem CID 88844681) has the molecular formula C7HCl3F6 and a molecular weight of 305.43 g/mol. Its IUPAC name is chloroform;1,2,3,4,5,6-hexafluorobenzene.

Molecular Properties

Compound Namechloroform;1,2,3,4,5,6-hexafluorobenzene
PubChem CID88844681
Molecular FormulaC7HCl3F6
Molecular Weight305.43 g/mol
Exact Mass303.90
IUPAC Namechloroform;1,2,3,4,5,6-hexafluorobenzene
SMILESClC(Cl)Cl.Fc1c(F)c(F)c(F)c(F)c1F
InChIInChI=1S/C6F6.CHCl3/c7-1-2(8)4(10)6(12)5(11)3(1)9;2-1(3)4/h;1H
InChIKeySKZLYOBYEQTZSY-UHFFFAOYSA-N
XLogP4.51
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.43
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of chloroform;1,2,3,4,5,6-hexafluorobenzene?
The IUPAC name of chloroform;1,2,3,4,5,6-hexafluorobenzene (CID 88844681) is chloroform;1,2,3,4,5,6-hexafluorobenzene.
What is the SMILES notation for chloroform;1,2,3,4,5,6-hexafluorobenzene?
The canonical SMILES for chloroform;1,2,3,4,5,6-hexafluorobenzene is ClC(Cl)Cl.Fc1c(F)c(F)c(F)c(F)c1F.
What is the InChIKey of chloroform;1,2,3,4,5,6-hexafluorobenzene?
The InChIKey is SKZLYOBYEQTZSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6F6.CHCl3/c7-1-2(8)4(10)6(12)5(11)3(1)9;2-1(3)4/h;1H.
What are the key properties of chloroform;1,2,3,4,5,6-hexafluorobenzene?
chloroform;1,2,3,4,5,6-hexafluorobenzene has a molecular weight of 305.43 g/mol, XLogP of 4.51, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloroform;1,2,3,4,5,6-hexafluorobenzene is sourced from PubChem (CID 88844681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).