bromomethane;fluoroform

C2H4BrF3 — CID 162541829

IUPACbromomethane;fluoroform
SMILESCBr.FC(F)F
InChIInChI=1S/CH3Br.CHF3/c1-2;2-1(3)4/h1H3;1H
InChIKeyZCCIUDDNUOWYAE-UHFFFAOYSA-N
MW164.95 g/mol
LogP2.19
Rot. Bonds

About bromomethane;fluoroform

bromomethane;fluoroform (PubChem CID 162541829) has the molecular formula C2H4BrF3 and a molecular weight of 164.95 g/mol. Its IUPAC name is bromomethane;fluoroform.

Molecular Properties

Compound Namebromomethane;fluoroform
PubChem CID162541829
Molecular FormulaC2H4BrF3
Molecular Weight164.95 g/mol
Exact Mass163.94
IUPAC Namebromomethane;fluoroform
SMILESCBr.FC(F)F
InChIInChI=1S/CH3Br.CHF3/c1-2;2-1(3)4/h1H3;1H
InChIKeyZCCIUDDNUOWYAE-UHFFFAOYSA-N
XLogP2.19
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.95
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bromomethane;fluoroform?
The IUPAC name of bromomethane;fluoroform (CID 162541829) is bromomethane;fluoroform.
What is the SMILES notation for bromomethane;fluoroform?
The canonical SMILES for bromomethane;fluoroform is CBr.FC(F)F.
What is the InChIKey of bromomethane;fluoroform?
The InChIKey is ZCCIUDDNUOWYAE-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3Br.CHF3/c1-2;2-1(3)4/h1H3;1H.
What are the key properties of bromomethane;fluoroform?
bromomethane;fluoroform has a molecular weight of 164.95 g/mol, XLogP of 2.19, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bromomethane;fluoroform is sourced from PubChem (CID 162541829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).