bromoethane;bromomethane

C3H8Br2 — CID 18359497

IUPACbromoethane;bromomethane
SMILESCBr.CCBr
InChIInChI=1S/C2H5Br.CH3Br/c1-2-3;1-2/h2H2,1H3;1H3
InChIKeyBYMUGBMRBYKYGV-UHFFFAOYSA-N
MW203.90 g/mol
LogP2.41
Rot. Bonds

About bromoethane;bromomethane

bromoethane;bromomethane (PubChem CID 18359497) has the molecular formula C3H8Br2 and a molecular weight of 203.90 g/mol. Its IUPAC name is bromoethane;bromomethane.

Molecular Properties

Compound Namebromoethane;bromomethane
PubChem CID18359497
Molecular FormulaC3H8Br2
Molecular Weight203.90 g/mol
Exact Mass201.90
IUPAC Namebromoethane;bromomethane
SMILESCBr.CCBr
InChIInChI=1S/C2H5Br.CH3Br/c1-2-3;1-2/h2H2,1H3;1H3
InChIKeyBYMUGBMRBYKYGV-UHFFFAOYSA-N
XLogP2.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.90
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze bromoethane;bromomethane 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 bromoethane;bromomethane?
The IUPAC name of bromoethane;bromomethane (CID 18359497) is bromoethane;bromomethane.
What is the SMILES notation for bromoethane;bromomethane?
The canonical SMILES for bromoethane;bromomethane is CBr.CCBr.
What is the InChIKey of bromoethane;bromomethane?
The InChIKey is BYMUGBMRBYKYGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5Br.CH3Br/c1-2-3;1-2/h2H2,1H3;1H3.
What are the key properties of bromoethane;bromomethane?
bromoethane;bromomethane has a molecular weight of 203.90 g/mol, XLogP of 2.41, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bromoethane;bromomethane is sourced from PubChem (CID 18359497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).