1,2-dibromoethane;1,1-dichloroethane;1,2-dichloroethane

C6H12Br2Cl4 — CID 161263882

IUPAC1,2-dibromoethane;1,1-dichloroethane;1,2-dichloroethane
SMILESBrCCBr.CC(Cl)Cl.ClCCCl
InChIInChI=1S/C2H4Br2.2C2H4Cl2/c3-1-2-4;1-2(3)4;3-1-2-4/h1-2H2;2H,1H3;1-2H2
InChIKeyVCXLDOCVQITSGU-UHFFFAOYSA-N
MW385.78 g/mol
LogP5.05
Rot. Bonds2

About 1,2-dibromoethane;1,1-dichloroethane;1,2-dichloroethane

1,2-dibromoethane;1,1-dichloroethane;1,2-dichloroethane (PubChem CID 161263882) has the molecular formula C6H12Br2Cl4 and a molecular weight of 385.78 g/mol. Its IUPAC name is 1,2-dibromoethane;1,1-dichloroethane;1,2-dichloroethane.

Molecular Properties

Compound Name1,2-dibromoethane;1,1-dichloroethane;1,2-dichloroethane
PubChem CID161263882
Molecular FormulaC6H12Br2Cl4
Molecular Weight385.78 g/mol
Exact Mass381.81
IUPAC Name1,2-dibromoethane;1,1-dichloroethane;1,2-dichloroethane
SMILESBrCCBr.CC(Cl)Cl.ClCCCl
InChIInChI=1S/C2H4Br2.2C2H4Cl2/c3-1-2-4;1-2(3)4;3-1-2-4/h1-2H2;2H,1H3;1-2H2
InChIKeyVCXLDOCVQITSGU-UHFFFAOYSA-N
XLogP5.05
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.78
LogP ≤ 55.05
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

Dowfume EB 5
CID 3041329
1,2-Dibromoethane;1,2-dichloroethane
CID 18628234
1,1,1,2-Tetrabromoethane;1,1,1,2-tetrachloroethane
CID 88146790
1,2-Dibromopropane;1,1,2,2-tetrachloroethane
CID 121414870
1,2-Dibromopropane;1,1,1,2-tetrachloroethane
CID 121414873
Bromoethane;1,2-dichloroethane
CID 158517593
1,1,2-Tribromoethane;1,1,2-trichloroethane
CID 160766102
1,2-Dibromoethane;1,1,1,2-tetrachloroethane;tetrachloromethane
CID 160938047
1,1-Dibromoethane;1,1,1,2-tetrachloroethane
CID 161919983
1,2-Dibromoethane;bis(1,2-dichloroethane)
CID 164130441
Bromo(chloro)methane;1,1-dichloroethane;1,2-dichloroethane
CID 174840112
1,1-Dibromopropane;1,1,1,2-tetrachloroethane
CID 174859427

Frequently Asked Questions

What is the IUPAC name of 1,2-dibromoethane;1,1-dichloroethane;1,2-dichloroethane?
The IUPAC name of 1,2-dibromoethane;1,1-dichloroethane;1,2-dichloroethane (CID 161263882) is 1,2-dibromoethane;1,1-dichloroethane;1,2-dichloroethane.
What is the SMILES notation for 1,2-dibromoethane;1,1-dichloroethane;1,2-dichloroethane?
The canonical SMILES for 1,2-dibromoethane;1,1-dichloroethane;1,2-dichloroethane is BrCCBr.CC(Cl)Cl.ClCCCl.
What is the InChIKey of 1,2-dibromoethane;1,1-dichloroethane;1,2-dichloroethane?
The InChIKey is VCXLDOCVQITSGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4Br2.2C2H4Cl2/c3-1-2-4;1-2(3)4;3-1-2-4/h1-2H2;2H,1H3;1-2H2.
What are the key properties of 1,2-dibromoethane;1,1-dichloroethane;1,2-dichloroethane?
1,2-dibromoethane;1,1-dichloroethane;1,2-dichloroethane has a molecular weight of 385.78 g/mol, XLogP of 5.05, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dibromoethane;1,1-dichloroethane;1,2-dichloroethane is sourced from PubChem (CID 161263882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).