Basic information
- CAS
36038-53-6- Standard SMILES
ClC(Cl)=CC=C(Cl)Cl- InChIKey
NDJKZBLOOIFFAS-UHFFFAOYSA-N- Molecular formula
- C4H2Cl4
- Average molar mass
- 191.9 g/mol
- Monoisotopic mass
- 189.891061
Names & identifiers
- Preferred name
- 1,3-Butadiene, 1,1,4,4-tetrachloro-
- IUPAC
- 1,1,4,4-tetrachlorobuta-1,3-diene
Names & synonyms
1,3-Butadiene, 1,1,4,4-tetrachloro-36038-53-6DTXSID7074038RefChem:1052732DTXCID70391291,1,4,4-Tetrachlorobutadiene1,1,4,4-TETRACHLOROBUTA-1,3-DIENE1,1,4,4-TetrachlorbutadienSCHEMBL31458650NDJKZBLOOIFFAS-UHFFFAOYSA-N1,1,4,4-Tetrachloro-1,3-butadiene #NS00005611
Database identifiers
- CAS
36038-53-6- PubChem CID
- 37345
- DTXSID
DTXSID7074038- Nikkaji
- J711.551B
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 100
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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