carbononitridic bromide;chloroform

C2HBrCl3N — CID 162167575

IUPACcarbononitridic bromide;chloroform
SMILESClC(Cl)Cl.N#CBr
InChIInChI=1S/CBrN.CHCl3/c2-1-3;2-1(3)4/h;1H
InChIKeyZNINESQYAYGNOX-UHFFFAOYSA-N
MW225.30 g/mol
LogP2.85
Rot. Bonds

About carbononitridic bromide;chloroform

carbononitridic bromide;chloroform (PubChem CID 162167575) has the molecular formula C2HBrCl3N and a molecular weight of 225.30 g/mol. Its IUPAC name is carbononitridic bromide;chloroform.

Molecular Properties

Compound Namecarbononitridic bromide;chloroform
PubChem CID162167575
Molecular FormulaC2HBrCl3N
Molecular Weight225.30 g/mol
Exact Mass222.84
IUPAC Namecarbononitridic bromide;chloroform
SMILESClC(Cl)Cl.N#CBr
InChIInChI=1S/CBrN.CHCl3/c2-1-3;2-1(3)4/h;1H
InChIKeyZNINESQYAYGNOX-UHFFFAOYSA-N
XLogP2.85
TPSA23.79 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 carbononitridic bromide;chloroform?
The IUPAC name of carbononitridic bromide;chloroform (CID 162167575) is carbononitridic bromide;chloroform.
What is the SMILES notation for carbononitridic bromide;chloroform?
The canonical SMILES for carbononitridic bromide;chloroform is ClC(Cl)Cl.N#CBr.
What is the InChIKey of carbononitridic bromide;chloroform?
The InChIKey is ZNINESQYAYGNOX-UHFFFAOYSA-N. The full InChI is InChI=1S/CBrN.CHCl3/c2-1-3;2-1(3)4/h;1H.
What are the key properties of carbononitridic bromide;chloroform?
carbononitridic bromide;chloroform has a molecular weight of 225.30 g/mol, XLogP of 2.85, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbononitridic bromide;chloroform is sourced from PubChem (CID 162167575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).