chloro(difluoro)methane;dichloro(difluoro)methane;trichloro(fluoro)methane

C3HCl6F5 — CID 19892956

IUPACchloro(difluoro)methane;dichloro(difluoro)methane;trichloro(fluoro)methane
SMILESFC(Cl)(Cl)Cl.FC(F)(Cl)Cl.FC(F)Cl
InChIInChI=1S/CCl3F.CCl2F2.CHClF2/c2*2-1(3,4)5;2-1(3)4/h;;1H
InChIKeyREEWMTJLDPNYMG-UHFFFAOYSA-N
MW344.75 g/mol
LogP5.75
Rot. Bonds

About chloro(difluoro)methane;dichloro(difluoro)methane;trichloro(fluoro)methane

chloro(difluoro)methane;dichloro(difluoro)methane;trichloro(fluoro)methane (PubChem CID 19892956) has the molecular formula C3HCl6F5 and a molecular weight of 344.75 g/mol. Its IUPAC name is chloro(difluoro)methane;dichloro(difluoro)methane;trichloro(fluoro)methane.

Molecular Properties

Compound Namechloro(difluoro)methane;dichloro(difluoro)methane;trichloro(fluoro)methane
PubChem CID19892956
Molecular FormulaC3HCl6F5
Molecular Weight344.75 g/mol
Exact Mass341.81
IUPAC Namechloro(difluoro)methane;dichloro(difluoro)methane;trichloro(fluoro)methane
SMILESFC(Cl)(Cl)Cl.FC(F)(Cl)Cl.FC(F)Cl
InChIInChI=1S/CCl3F.CCl2F2.CHClF2/c2*2-1(3,4)5;2-1(3)4/h;;1H
InChIKeyREEWMTJLDPNYMG-UHFFFAOYSA-N
XLogP5.75
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.75
LogP ≤ 55.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Hcfc-22 cfc-12
CID 17911091
Chloro(difluoro)methane;trichloro(fluoro)methane
CID 19806419
Dichloro(difluoro)methane;dichloro(fluoro)methane
CID 21562133
Chloro-(difluoromethylchloranuidyl)-difluoromethane
CID 58813255
Chloro(difluoro)methane;chloroform
CID 87266930
Chloroform;dichloro(difluoro)methane
CID 87397962
Dichloro(fluoro)methane;tetrafluoromethane
CID 88628487
Dichloro(fluoro)methane;1,1-dichloro-1,2,2,2-tetrafluoroethane
CID 88724566
Chloro(difluoro)methane;1,1,1-trichloro-2,2,2-trifluoroethane
CID 88770689
CID 91865920
CID 91865920
Chloro(fluoro)methane;1,1,1-trichloro-2,2,2-trifluoroethane
CID 162534492
Chloroform;dichloro(difluoro)methane;dichloromethane
CID 157274699

Frequently Asked Questions

What is the IUPAC name of chloro(difluoro)methane;dichloro(difluoro)methane;trichloro(fluoro)methane?
The IUPAC name of chloro(difluoro)methane;dichloro(difluoro)methane;trichloro(fluoro)methane (CID 19892956) is chloro(difluoro)methane;dichloro(difluoro)methane;trichloro(fluoro)methane.
What is the SMILES notation for chloro(difluoro)methane;dichloro(difluoro)methane;trichloro(fluoro)methane?
The canonical SMILES for chloro(difluoro)methane;dichloro(difluoro)methane;trichloro(fluoro)methane is FC(Cl)(Cl)Cl.FC(F)(Cl)Cl.FC(F)Cl.
What is the InChIKey of chloro(difluoro)methane;dichloro(difluoro)methane;trichloro(fluoro)methane?
The InChIKey is REEWMTJLDPNYMG-UHFFFAOYSA-N. The full InChI is InChI=1S/CCl3F.CCl2F2.CHClF2/c2*2-1(3,4)5;2-1(3)4/h;;1H.
What are the key properties of chloro(difluoro)methane;dichloro(difluoro)methane;trichloro(fluoro)methane?
chloro(difluoro)methane;dichloro(difluoro)methane;trichloro(fluoro)methane has a molecular weight of 344.75 g/mol, XLogP of 5.75, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro(difluoro)methane;dichloro(difluoro)methane;trichloro(fluoro)methane is sourced from PubChem (CID 19892956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).