1,1,2,4-Tetrachlorobut-1-en-3-yne
Basic information
- CAS
5658-91-3- Standard SMILES
ClC#CC(Cl)=C(Cl)Cl- InChIKey
YOKYQLFAWHTQRR-UHFFFAOYSA-N- Molecular formula
- C4Cl4
- Average molar mass
- 189.8 g/mol
- Monoisotopic mass
- 187.875411
Names & identifiers
- Preferred name
- 1,1,2,4-Tetrachlorobut-1-en-3-yne
- IUPAC
- 1,1,2,4-tetrachlorobut-1-en-3-yne
Names & synonyms
1,1,2,4-tetrachlorobut-1-en-3-yne1-buten-3-yne, 1,1,2,4-tetrachloro-5658-91-3DTXSID70348729RefChem:213212DTXCID50299801InChI=1/C4Cl4/c5-2-1-3(6)4(7)perchlorobutenyne
Database identifiers
- CAS
5658-91-3- PubChem CID
- 640386
- DTXSID
DTXSID70348729- Nikkaji
- J745.528C
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 163
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Related reactions
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Compound notes
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