Basic information
- CAS
6889-41-4- Standard SMILES
O=C1NC(=O)C2C1C1(Cl)C(Cl)=C(Cl)C2(Cl)C1(Cl)Cl- InChIKey
VTOLQEMXZUTSMA-UHFFFAOYSA-N- Molecular formula
- C9H3Cl6NO2
- Average molar mass
- 369.8 g/mol
- Monoisotopic mass
- 366.829495
Names & identifiers
- Preferred name
- 1,4,5,6,7,7-Hexachlorobicyclo(2.2.1)-5-heptene-2,3-dicarboximide
- IUPAC
- 1,7,8,9,10,10-hexachloro-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
- English name
- 1,4,5,6,7,7-Hexachlorobicyclo(2.2.1)-5-heptene-2,3-dicarboximide
- Molecular formula
- C9H3Cl6NO2
- Molecular weight
- 369.84
Names & synonyms
1,4,5,6,7,7-HEXACHLOROBICYCLO(2.2.1)-5-HEPTENE-2,3-DICARBOXIMIDERefChem:415774654-304-9Chlorendic imide6889-41-4MLS0026388591,7,8,9,10,10-hexachloro-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dioneNSC 22222NSC222221,4,5,6,7,7-Hexachloro-5-norbornene-2,3-dicarboximide5-Norbornene-2,3-dicarboximide, 1,4,5,6,7,7-hexachloro-1,4,5,6,7,7-Hexachlorobicyclo(2.2.1)heptene-2,3-dicarboximide
Show more names
chlorendicimideTIMTEC-BB SBB008442VTOLQEMXZUTSMA-UHFFFAOYSA-NWln: T C555 A dvmv iutj ag ag bg hg ig jg1,4,5,6,7,7-hexachloro-5-norbornene-3-dicarboximide
4,7-Methano-1H-isoindole-1,3(2H)-dione, 4,5,6,7,8,8-hexachloro-3a,4,7,7a-tetrahydro-CHEMBL3185823SCHEMBL10397616DTXSID40988590HMS3082C23NSC-22222SBB008442AKOS001054855
Database identifiers
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 501
Physicochemical properties
- Melting point
- 273 · 273-273.5 °C
- Boiling point
- 55 °C · 55°C (rough estimate)
- Density
- 1.719 · 1.7190 (rough estimate)
- refractive index
- 1.6 · 1.6000 (estimate)
- pka
- 0.609 · 0.609±0.70(predicted)
- EWG's Food Scores
- 1 · 1
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301
- Precautionary statements
- 264 · P264-P270-P301+P310-P321-P330-P405-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P301+P316, P321, P330, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- Hazard statements
- H301
- Precautionary statements
- P264-P270-P301+P310-P321-P330-P405-P501
Chemistry & industry
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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