Basic information
- CAS
52403-44-8- Standard SMILES
CC(Cl)=CC(Cl)Cl- InChIKey
SELHJAWKAFQYQR-UHFFFAOYSA-N- Molecular formula
- C4H5Cl3
- Average molar mass
- 159.44 g/mol
Names & identifiers
- Preferred name
- 1,1,3-Trichloro-2-butene
- IUPAC
- 1,1,3-trichlorobut-2-ene
- English name
- 1,1,3-Trichloro-2-butene
- Molecular formula
- C4H5Cl3
- Molecular weight
- 159.44
Names & synonyms
1,1,3-Trichloro-2-buteneSCHEMBL5317329DB-30081352403-44-82-Butene, 1,1,3-trichloro-(Z)-1,1,3-trichlorobut-2-ene
Database identifiers
- CAS
52403-44-8
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 75
Physicochemical properties
- Boiling point
- 169.463 · 169.463±30.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.301 · 1.301±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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