1,1,2,2-tetrabromoethene;tetrachloromethane

C3Br4Cl4 — CID 174595254

IUPAC1,1,2,2-tetrabromoethene;tetrachloromethane
SMILESBrC(Br)=C(Br)Br.ClC(Cl)(Cl)Cl
InChIInChI=1S/C2Br4.CCl4/c3-1(4)2(5)6;2-1(3,4)5
InChIKeyMLZKPEAUZIRXRB-UHFFFAOYSA-N
MW497.46 g/mol
LogP6.25
Rot. Bonds

About 1,1,2,2-tetrabromoethene;tetrachloromethane

1,1,2,2-tetrabromoethene;tetrachloromethane (PubChem CID 174595254) has the molecular formula C3Br4Cl4 and a molecular weight of 497.46 g/mol. Its IUPAC name is 1,1,2,2-tetrabromoethene;tetrachloromethane.

Molecular Properties

Compound Name1,1,2,2-tetrabromoethene;tetrachloromethane
PubChem CID174595254
Molecular FormulaC3Br4Cl4
Molecular Weight497.46 g/mol
Exact Mass491.55
IUPAC Name1,1,2,2-tetrabromoethene;tetrachloromethane
SMILESBrC(Br)=C(Br)Br.ClC(Cl)(Cl)Cl
InChIInChI=1S/C2Br4.CCl4/c3-1(4)2(5)6;2-1(3,4)5
InChIKeyMLZKPEAUZIRXRB-UHFFFAOYSA-N
XLogP6.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500497.46
LogP ≤ 56.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 1,1,2,2-tetrabromoethene;tetrachloromethane with MolForge

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

Launch Full Analysis

Related Compounds

tetrachloromethane;trihydrobromide
CID 172821605
tetrachloromethane;hexahydrofluoride
CID 172761965
tetrachloromethane;dihydrochloride
CID 139954008
2-bromo-3,3-dichlorobut-1-ene
CID 12836192
potassium;tetrachloromethane;hydroxide
CID 159473553
barium(2+);tetrachloromethane;dichloride
CID 141230689
acetylene;tetrachloromethane
CID 19386607
methane;tetrachloromethane;dihydrochloride
CID 173442667
bromo(trichloro)methane
CID 6383
1,1,1,2,2,2-hexachloroethane;tetrachloromethane
CID 87168985
ethanol;tetrachloromethane
CID 23446399
nitrous acid;tetrachloromethane
CID 88765701

Frequently Asked Questions

What is the IUPAC name of 1,1,2,2-tetrabromoethene;tetrachloromethane?
The IUPAC name of 1,1,2,2-tetrabromoethene;tetrachloromethane (CID 174595254) is 1,1,2,2-tetrabromoethene;tetrachloromethane.
What is the SMILES notation for 1,1,2,2-tetrabromoethene;tetrachloromethane?
The canonical SMILES for 1,1,2,2-tetrabromoethene;tetrachloromethane is BrC(Br)=C(Br)Br.ClC(Cl)(Cl)Cl.
What is the InChIKey of 1,1,2,2-tetrabromoethene;tetrachloromethane?
The InChIKey is MLZKPEAUZIRXRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C2Br4.CCl4/c3-1(4)2(5)6;2-1(3,4)5.
What are the key properties of 1,1,2,2-tetrabromoethene;tetrachloromethane?
1,1,2,2-tetrabromoethene;tetrachloromethane has a molecular weight of 497.46 g/mol, XLogP of 6.25, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,2-tetrabromoethene;tetrachloromethane is sourced from PubChem (CID 174595254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).