Basic information
- CAS
623940-59-0- Standard SMILES
O=C(/C=C/c1ccccc1)Nc1c(Cl)cc(Cl)cc1Cl- InChIKey
CXHYCBMCRQKTNA-VOTSOKGWSA-N- Molecular formula
- C15H10Cl3NO
- Average molar mass
- 326.6 g/mol
- Monoisotopic mass
- 324.982797
Names & identifiers
- Preferred name
- 3-Phenyl-N-(2,4,6-trichlorophenyl)acrylamide
- IUPAC
- (E)-3-phenyl-N-(2,4,6-trichlorophenyl)prop-2-enamide
- English name
- SALOR-INT L448389-1EA
- Molecular formula
- C15H10Cl3NO
- Molecular weight
- 326.61
Names & synonyms
3-PHENYL-N-(2,4,6-TRICHLOROPHENYL)ACRYLAMIDE623940-59-0RefChem:504905644-979-8AKOS016621138SALOR-INT L448389-1EA
Database identifiers
- CAS
623940-59-0- PubChem CID
- 5901075
- EC Number
- 644-979-8
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 343
Physicochemical properties
- Boiling point
- 491.622 · 491.622±45.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.437 · 1.437±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 11.24 · 11.240±0.70(predicted)
- Symbol(GHS)
- 9 · GHS09
- Hazard statements
- 411 · H411
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
H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P273, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAquatic Chronic 2 (100%)
Safety data
- Symbol(GHS)
- GHS09
- Hazard statements
- H411
Chemistry & industry
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SIGMAALDRICH—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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