Basic information
- CAS
2431-54-1- Standard SMILES
ClCC=C(Cl)CCl- InChIKey
SXCATGXBSQWDDJ-UHFFFAOYSA-N- Molecular formula
- C4H5Cl3
- Average molar mass
- 159.44 g/mol
- Monoisotopic mass
- 157.945683
Names & identifiers
- Preferred name
- 1,2,4-Trichloro-2-butene
- IUPAC
- 1,2,4-trichlorobut-2-ene
Names & synonyms
2431-54-1DTXSID0010309311,2,4-TRICHLORO-2-BUTENERefChem:71543DTXCID001515991219-398-41,2,4-Trichlorobut-2-ene1,2,4-trichloro-but-2-eneSCHEMBL2491217NS00046872
Database identifiers
- CAS
2431-54-1- PubChem CID
- 17074
- DTXSID
DTXSID001030931- EC Number
- 219-398-4
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 67.3
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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