(E)-1-bromo-1,2-dichloroethene

C2HBrCl2 — CID 15120764

IUPAC(E)-1-bromo-1,2-dichloroethene
SMILESCl/C=C(\Cl)Br
InChIInChI=1S/C2HBrCl2/c3-2(5)1-4/h1H/b2-1-
InChIKeyRXIALFZUTHFURS-UPHRSURJSA-N
MW175.84 g/mol
LogP2.66
Rot. Bonds

About (E)-1-bromo-1,2-dichloroethene

(E)-1-bromo-1,2-dichloroethene (PubChem CID 15120764) has the molecular formula C2HBrCl2 and a molecular weight of 175.84 g/mol. Its IUPAC name is (E)-1-bromo-1,2-dichloroethene.

Molecular Properties

Compound Name(E)-1-bromo-1,2-dichloroethene
PubChem CID15120764
Molecular FormulaC2HBrCl2
Molecular Weight175.84 g/mol
Exact Mass173.86
IUPAC Name(E)-1-bromo-1,2-dichloroethene
SMILESCl/C=C(\Cl)Br
InChIInChI=1S/C2HBrCl2/c3-2(5)1-4/h1H/b2-1-
InChIKeyRXIALFZUTHFURS-UPHRSURJSA-N
XLogP2.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.84
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze (E)-1-bromo-1,2-dichloroethene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (E)-1-bromo-1,2-dichloroethene?
The IUPAC name of (E)-1-bromo-1,2-dichloroethene (CID 15120764) is (E)-1-bromo-1,2-dichloroethene.
What is the SMILES notation for (E)-1-bromo-1,2-dichloroethene?
The canonical SMILES for (E)-1-bromo-1,2-dichloroethene is Cl/C=C(\Cl)Br.
What is the InChIKey of (E)-1-bromo-1,2-dichloroethene?
The InChIKey is RXIALFZUTHFURS-UPHRSURJSA-N. The full InChI is InChI=1S/C2HBrCl2/c3-2(5)1-4/h1H/b2-1-.
What are the key properties of (E)-1-bromo-1,2-dichloroethene?
(E)-1-bromo-1,2-dichloroethene has a molecular weight of 175.84 g/mol, XLogP of 2.66, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-bromo-1,2-dichloroethene is sourced from PubChem (CID 15120764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).