Basic information
- CAS
3993-94-0- Standard SMILES
ClCCCCCC=C(Cl)Cl- InChIKey
PSSICVWETCAXGQ-UHFFFAOYSA-N- Molecular formula
- C7H11Cl3
- Average molar mass
- 201.5 g/mol
- Monoisotopic mass
- 199.992633
Names & identifiers
- Preferred name
- 1,1,7-Trichloro-1-heptene
- IUPAC
- 1,1,7-trichlorohept-1-ene
- English name
- 1,1,7-Trichloro-1-heptene
- Molecular formula
- C7H11Cl3
- Molecular weight
- 201.52
Names & synonyms
1,1,7-Trichloro-1-heptene1-Heptene, 1,1,7-trichloro-3993-94-0DTXSID50337636RefChem:70978DTXCID80288723PSSICVWETCAXGQ-UHFFFAOYSA-N1,1,7-trichlorohept-1-eneSCHEMBL11613483
Database identifiers
- CAS
3993-94-0- PubChem CID
- 543776
- DTXSID
DTXSID50337636- Nikkaji
- J99.641F
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 95
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
Physicochemical properties
- Boiling point
- 98 · 98-101 °C(Press: 8 Torr)
- Density
- 1.19 g/cm3 · 1.1900 g/cm3
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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